| NAME | CAS | FORMULA | MW | TerraQSAR - LOGP |
| nedaplatin | 95734-82-0 | C2H6N2O3Pt | 301.17 | -1.04 |
|
| L-alanosine | 5854-93-3 | C3H7N3O4 | 149.11 | -2.16 |
|
| pamidronic acid | 40391-99-9 | C3H11NO7P2 | 235.07 | -3.48 |
|
| oteracil | 937-13-3 | C4H3N3O4 | 157.08 | -0.46 |
|
| imexon | 59643-91-3 | C4H5N3O | 111.10 | 0.03 |
|
| timonacic | 444-27-9 | C4H7NO2S | 133.17 | -1.83 |
|
| palifosfamide | 31645-39-3 | C4H11Cl2N2O2P | 221.02 | |
|
| gimeracil | 103766-25-2 | C5H4ClNO2 | 145.54 | 0.96 |
|
| nitrogen mustard oxide | 302-70-5 | C5H12Cl3NO | 208.52 | -1.66 |
|
| bisazir | 13687-09-7 | C5H12N3PS | 177.21 | 0.53 |
|
| mitoguazone | 459-86-9 | C5H12N8 | 184.21 | -0.83 |
|
| oxophenarsine | 306-12-7 | C6H6AsNO2 | 199.04 | 1.08 |
|
| dezaguanine | 41729-52-6 | C6H6N4O | 150.14 | -0.44 |
|
| temozolomide | 85622-93-1 | C6H6N6O2 | 194.15 | -0.24 |
|
| picoplatin | 181630-15-9 | C6H10Cl2N2Pt | 376.16 | 1.29 |
|
| sparfosic acid | 51321-79-0 | C6H10NO8P | 255.12 | -2.55 |
|
| dacarbazine | 4342-03-4 | C6H10N6O | 182.18 | -0.24 |
|
| caracemide | 81424-67-1 | C6H11N3O4 | 189.17 | -0.67 |
|
| eflornithine | 70052-12-9 | C6H12F2N2O2 | 182.17 | 0.56 |
|
| dexormaplatin | 96392-96-0 | C6H14Cl4N2Pt | 451.09 | -3.33 |
|
| tirapazamine | 27314-97-2 | C7H6N4O2 | 178.15 | 2.04 |
|
| mitozolomide | 85622-95-3 | C7H7ClN6O2 | 242.63 | -0.24 |
|
| etanidazole | 22668-01-5 | C7H10N4O4 | 214.18 | -0.31 |
|
| misonidazole | 13551-87-6 | C7H11N3O4 | 201.18 | -0.01 |
|
| neptamustine | 73105-03-0 | C7H14ClN3O2 | 207.66 | 2.01 |
|
| novembichin | 1936-40-9 | C7H14Cl3N | 218.55 | 0.94 |
|
| uredepa | 302-49-8 | C7H14N3O3P | 219.18 | -0.33 |
|
| tauromustine | 85977-49-7 | C7H15ClN4O4S | 286.74 | 0.71 |
|
| perfosfamide | 62435-42-1 | C7H16ClN2O5P | 274.64 | 0.62 |
|
| norcantharidine | 5442-12-6 | C8H8O4 | 168.15 | 0.86 |
|
| tegafur; ftorafur | 17902-23-7 | C8H9FN2O3 | 200.17 | -0.75 |
|
| oxisuran | 27302-90-5 | C8H9NO2S | 183.23 | 0.32 |
|
| iobenguane [131-I] | 77679-27-7 | C8H10IN3 | 275.09 | 3.31 |
|
| L-mimosine | 500-44-7 | C8H10N2O4 | 198.18 | -0.11 |
|
| duazomycin | 1403-47-0 | C8H11N3O4 | 213.19 | 1.98 |
|
| ambazone | 539-21-9 | C8H11N7S | 237.29 | -0.56 |
|
| fazarabine | 65886-71-7 | C8H12N4O5 | 244.21 | -0.31 |
|
| oxaliplatin | 61825-94-3 | C8H14N2O4Pt | 397.30 | -1.20 |
|
| azatepa | 125-45-1 | C8H14N5OPS | 259.27 | 1.53 |
|
| swainsonine; tridolgosir | 72741-87-8 | C8H15NO3 | 173.21 | -1.00 |
|
| spiroplatin | 74790-08-2 | C8H16N2O4PtS | 431.38 | 1.27 |
|
| gloxazone | 2507-91-7 | C8H16N6OS2 | 276.38 | -0.19 |
|
| sufosfamide | 37753-10-9 | C8H18ClN2O5PS | 320.73 | -0.52 |
|
| improsulfan | 13425-98-4 | C8H19NO6S2 | 289.37 | -0.52 |
|
| argimesna | 106854-46-0 | C8H20N4O5S2 | 316.40 | -4.20 |
|
| irsogladine | 57381-26-7 | C9H7Cl2N5 | 256.10 | 1.36 |
|
| thiamiprine; tiamiprine | 5581-52-2 | C9H8N8O2S | 292.28 | 0.10 |
|
| flurocitabine | 37717-21-8 | C9H10FN3O4 | 243.19 | 0.60 |
|
| fiacitabine | 69123-90-6 | C9H11FIN3O4 | 371.11 | 0.33 |
|
| doxifluridine | 3094-09-5 | C9H11FN2O5 | 246.19 | -1.16 |
|
| ropidoxuridine | 93265-81-7 | C9H11IN2O4 | 338.10 | -1.16 |
|
| ancitabine | 31698-14-3 | C9H11N3O4 | 225.20 | 0.75 |
|
| nimustine | 42471-28-3 | C9H13ClN6O2 | 272.70 | 1.05 |
|
| zinostatin; neocarzinostatin | 9014-02-2 | C9H13NO2S | 199.27 | 2.36 |
|
| mizoribine | 50924-49-7 | C9H13N3O6 | 259.22 | -1.12 |
|
| pyrazofurin; pyrazomycin | 30868-30-5 | C9H13N3O6 | 259.22 | 1.15 |
|
| lobaplatin | 135558-11-1 | C9H16N2O3Pt | 395.33 | 1.48 |
|
| trofosfamide | 22089-22-1 | C9H18Cl3N2O2P | 323.59 | 0.75 |
|
| altretamine | 645-05-6 | C9H18N6 | 210.28 | 2.73 |
|
| talabostat | 149682-77-9 | C9H19BN2O3 | 214.07 | 0.71 |
|
| mafosfamide | 88859-04-5 | C9H19Cl2N2O5PS2 | 401.27 | 1.90 |
|
| bropirimine | 56741-95-8 | C10H8BrN3O | 266.10 | 1.33 |
|
| clofarabine | 123318-82-1 | C10H11ClFN5O3 | 303.68 | -0.31 |
|
| tocladesine | 41941-56-4 | C10H11ClN5O6P | 363.65 | 1.90 |
|
| baclofen | 1134-47-0 | C10H12ClNO2 | 213.66 | -0.80 |
|
| tezacitabine | 130306-02-4 | C10H12FN3O4 | 257.22 | 2.02 |
|
| fludarabine phosphate | 75607-67-9 | C10H13FN5O7P | 365.21 | 0.28 |
|
| tiazofurine | 60084-10-8 | C10H14N2O3S | 242.30 | 1.11 |
|
| tenuazonic acid | 610-88-8 | C10H15NO3 | 197.23 | 1.35 |
|
| semustine | 13909-09-6 | C10H18ClN3O2 | 247.72 | 3.30 |
|
| ecomustine | 98383-18-7 | C10H18ClN3O6 | 311.72 | 0.14 |
|
| ranimustine | 58994-96-0 | C10H18ClN3O7 | 327.72 | -0.69 |
|
| glufosfamide | 132682-98-5 | C10H21Cl2N2O7P | 383.16 | -0.85 |
|
| mannomustine | 576-68-1 | C10H22Cl2N2O4 | 305.20 | -0.75 |
|
| satraplatin | 129580-63-8 | C10H22Cl2N2O4Pt | 500.29 | 1.65 |
|
| mannosulfan | 7518-35-6 | C10H22O14S4 | 494.53 | -0.48 |
|
| ritrosulfan | 4148-16-7 | C10H24N2O8S2 | 364.44 | -0.49 |
|
| metoprine | 7761-45-7 | C11H10Cl2N4 | 269.13 | 2.69 |
|
| nilutamide | 63612-50-0 | C11H10F4N3O4 | 324.21 | 2.31 |
|
| flutamide | 13311-84-7 | C11H11F3N2O3 | 276.21 | 3.35 |
|
| forodesine | 209799-67-7 | C11H14N4O4 | 266.26 | -0.49 |
|
| sardomozide | 149400-88-4 | C11H14N6 | 230.27 | -1.19 |
|
| anaxirone | 77658-97-0 | C11H15N3O5 | 269.26 | -0.56 |
|
| carmofur | 61422-45-5 | C11H16FN3O3 | 257.26 | -0.82 |
|
| miboplatin | 103775-75-3 | C11H18N2O4Pt | 437.36 | 1.53 |
|
| sebriplatin | 110172-45-7 | C11H20N2O4Pt | 439.38 | 0.89 |
|
| zeniplatin | 111490-36-9 | C11H20N2O6Pt | 471.38 | 0.26 |
|
| meturedepa | 1661-29-6 | C11H22N3O3P | 275.29 | 1.57 |
|
| tasisulam | 519055-62-0 | C11H6BrCl2NO3S2 | 415.12 | 0.38 |
|
| triplatin tetranitrate | 172903-00-3 | C12H50Cl2N14O12Pt3 | 1238.79 | 0.13 |
|
| pirfenidone | 53179-13-8 | C12H11NO | 185.23 | 1.68 |
|
| peldesine | 133432-71-0 | C12H11N5O | 241.25 | 0.58 |
|
| tegafur-uracil | 74578-38-4 | C12H13FN4O5 | 312.26 | 0.04 |
|
| trenimon; triaziquone | 68-76-8 | C12H13N3O2 | 231.25 | -0.13 |
|
| benaxibine | 27661-27-4 | C12H15NO6 | 269.25 | 1.64 |
|
| benzodepa | 1980-45-6 | C12H16N3O3P | 281.25 | 1.79 |
|
| nelzarabine | 121032-29-9 | C12H17N5O5 | 311.30 | -0.54 |
|
| pumitepa | 42061-52-9 | C12H19N8OP | 322.31 | 0.28 |
|
| darinaparsin | 69819-86-9 | C12H22AsN3O6S | 411.31 | -0.89 |
|
| piposulfan | 2608-24-4 | C12H22N2O8S2 | 386.44 | -0.46 |
|
| etoglucid | 1954-28-5 | C12H22O6 | 262.30 | 0.10 |
|
| batabulin | 195533-53-0 | C13H7F6NO3S | 371.25 | 2.67 |
|
| pomalidomide | 19171-19-8 | C13H11N3O4 | 273.25 | 1.01 |
|
| zilascorb [2-H] | 122431-96-3 | C13H12O6 | 264.23 | -0.64 |
|
| dinalin | 58338-59-3 | C13H13N3O | 227.27 | 0.12 |
|
| lenalidomide [both enantiomers] | 191732-72-6 | C13H13N3O3 | 259.26 | 0.77 |
|
| metomidate | 5377-20-8 | C13H14N2O2 | 230.27 | 1.89 |
|
| triciribine | 35943-35-2 | C13H16N6O4 | 320.31 | -0.30 |
|
| sparsomycin | 1404-64-4 | C13H19N3O5S2 | 361.44 | 1.29 |
|
| enloplatin | 111523-41-2 | C13H22N2O5Pt | 481.42 | 1.02 |
|
| indisulam | 165668-41-7 | C14H12ClN3O4S2 | 385.85 | -0.17 |
|
| neocuproine | 484-11-7 | C14H12N2 | 208.26 | 2.02 |
|
| mitindomide | 10403-51-7 | C14H12N2O4 | 272.26 | 3.11 |
|
| nolatrexed | 147149-76-6 | C14H12N4OS | 284.34 | 3.53 |
|
| fadrozole | 102676-47-1 | C14H13N3 | 223.28 | 2.05 |
|
| simtrazene | 5579-27-1 | C14H16N4 | 240.31 | 3.82 |
|
| fotretamine | 37132-72-2 | C14H28N9OP3 | 431.36 | -0.46 |
|
| LY-83583 | 91300-60-6 | C15H10N2O2 | 250.26 | 3.34 |
|
| daniquidone | 67199-66-0 | C15H11N3O | 249.27 | 1.83 |
|
| idronoxil; dehydroequol; phenoxodiol | 81267-65-4 | C15H12O3 | 240.26 | 3.10 |
|
| semaxanib; SU-5416 | 194413-58-6 | C15H14N2O | 238.29 | 2.40 |
|
| tacedinaline | 112522-64-2 | C15H15N3O2 | 269.30 | 1.17 |
|
| apaziquone | 114560-48-4 | C15H16N2O4 | 288.30 | 0.85 |
|
| irofulven | 158440-71-2 | C15H18O3 | 246.31 | 4.77 |
|
| carboquone | 24279-91-2 | C15H19N3O5 | 321.33 | -0.40 |
|
| damsin | 1216-42-8 | C15H20O3 | 248.32 | 2.90 |
|
| riboprine | 7724-76-7 | C15H21N5O4 | 335.36 | -0.67 |
|
| capecitabine | 154361-50-9 | C15H24FN3O6 | 361.37 | 0.53 |
|
| marimastat | 154039-60-8 | C15H29N3O5 | 331.41 | -0.91 |
|
| vorozole | 118949-22-7 | C16H13ClN6 | 324.77 | 2.24 |
|
| laromustine | 173424-77-6 | C6H14ClN3O5S2 | 307.77 | 0.83 |
|
| clanfenur | 51213-99-1 | C16H15ClFN3O2 | 335.77 | 3.84 |
|
| sulofenur | 110311-27-8 | C16H15ClN2O3S | 350.82 | 2.15 |
|
| mitonafide | 54824-17-8 | C16H15N3O4 | 313.31 | 1.93 |
|
| antramycin | 4803-27-4 | C16H17N3O4 | 315.33 | 1.45 |
|
| bendamustine | 16506-27-7 | C16H21Cl2N3O2 | 358.27 | 2.07 |
|
| inproquone | 436-40-8 | C16H22N2O4 | 306.36 | -0.13 |
|
| geroquinol | 10457-66-6 | C16H22O2 | 246.35 | 1.51 |
|
| ubenimex | 58970-76-6 | C16H24N2O4 | 308.38 | -1.17 |
|
| yttrium [90-Y] tacatuzumab tetraxetan | 476413-07-7 | C16H25N5O7[90Y] | 489.40 | 0.09 |
|
| cioteronel | 89672-11-7 | C16H28O2 | 252.40 | 6.01 |
|
| tilomisole | 58433-11-7 | C17H11ClN2O2S | 342.80 | 2.46 |
|
| letrozole | 112809-51-5 | C17H11N5 | 285.31 | 2.59 |
|
| mitoflaxone | 87626-55-9 | C17H12O4 | 280.28 | 3.40 |
|
| liarozole | 115575-11-6 | C17H13ClN4 | 308.77 | 2.50 |
|
| vadimezan | 117570-53-3 | C17H14O4 | 282.29 | 3.36 |
|
| anastrozole; Arimidex | 120511-73-1 | C17H19N5 | 293.37 | 2.99 |
|
| mivobulin | 122332-18-7 | C17H19N5O2 | 325.37 | 3.26 |
|
| piritrexim | 72732-56-0 | C17H19N5O2 | 325.37 | 1.17 |
|
| pixantrone | 144510-96-3 | C17H19N5O2 | 325.37 | 2.04 |
|
| propamidine | 104-32-5 | C17H20N4O2 | 312.37 | 2.14 |
|
| mycophenolic acid | 24280-93-1 | C17H20O6 | 320.34 | 2.83 |
|
| azotomycin | 7644-67-9 | C17H23N7O8 | 453.41 | 0.46 |
|
| muricatacin | 134698-86-5 | C17H32O3 | 284.43 | 0.52 |
|
| intiquinatine; [formerly tiliquinatine] | 445041-75-8 | C18H14BrNO4 | 388.22 | 3.57 |
|
| roquinimex | 84088-42-6 | C18H16N2O3 | 308.34 | 3.10 |
|
| pinafide | 54824-20-3 | C18H17N3O4 | 339.35 | 2.16 |
|
| cevipabulin | 849550-05-6 | C18H18ClF5N6O | 464.83 | 2.76 |
|
| denibulin | 284019-34-7 | C18H19N5O3S | 385.45 | 3.11 |
|
| nitracrine | 4533-39-5 | C18H20N4O2 | 324.38 | 2.23 |
|
| prinomastat; AG-3340 | 192329-42-3 | C18H21N3O5S2 | 423.51 | 1.63 |
|
| see CAS 84-16-2 | 5635-50-7 | C18H22O2 | 270.37 | 5.07 |
|
| masoprocol | 27686-84-6 | C18H22O4 | 302.37 | 3.03 |
|
| nor-dihydroguaiaretic acid | 500-38-9 | C18H22O4 | 302.37 | 3.05 |
|
| dibrospidium chloride | 86641-76-1 | C18H32Br2Cl2N4O2 | 567.20 | -1.18 |
|
| prospidium chloride | 23476-83-7 | C18H36Cl4N4O2 | 482.32 | -1.56 |
|
| safingol | 15639-50-6 | C18H39NO2 | 301.51 | 5.79 |
|
| elesclomol | 488832-69-5 | C19H20N4O2S2 | 400.52 | 1.62 |
|
| galocitabine | 124012-42-6 | C19H22FN3O8 | 439.40 | 1.30 |
|
| trimetrexate | 52128-35-5 | C19H23N5O3 | 369.42 | 1.03 |
|
| testolactone | 968-93-4 | C19H24O3 | 300.40 | 2.32 |
|
| bortezomib | 179324-69-7 | C19H25BN4O4 | 384.24 | -0.45 |
|
| seliciclib; Roscovitine | 186692-46-6 | C19H26N6O | 354.46 | 1.57 |
|
| fostriecin | 87810-56-8 | C19H27O9P | 430.39 | 5.83 |
|
| mopidamol | 13665-88-8 | C19H31N7O4 | 421.50 | 0.95 |
|
| annosquamosin B | 177742-56-2 | C19H32O3 | 308.46 | 4.02 |
|
| mitoquidone | 91753-07-0 | C20H13NO2 | 299.33 | 3.27 |
|
| vatalanib; PTK-787 | 212141-54-3 | C20H15ClN4 | 346.82 | 2.26 |
|
| rubitecan | 91421-42-0 | C20H15N3O6 | 393.35 | 2.34 |
|
| telantinib | 332012-40-5 | C20H16ClN5O3 | 409.83 | 2.06 |
|
| exisulind | 59973-80-7 | C20H17FO4S | 372.41 | 0.55 |
|
| obatoclax | 803712-67-6 | C20H19N3O | 317.39 | 2.93 |
|
| acodazole | 79152-85-5 | C20H19N5O | 345.41 | 4.79 |
|
| pemetrexed disodium salt | 150399-23-8 | C20H21N5Na2O6 | 473.4 | 3.02 |
|
| pemetrexed | 137281-23-3 | C20H21N5O6 | 427.42 | 0.68 |
|
| ninopterin | 2179-16-0 | C20H21N7O6 | 455.43 | -1.85 |
|
| piroxantrone | 91441-23-5 | C20H23N5O4 | 397.43 | 1.53 |
|
| BBR-34384 | 438244-41-8 | C20H24N6O2 | 380.45 | 3.90 |
|
| nortopixantrone | 156090-17-4 | C20H24N6O2 | 380.45 | 3.90 |
|
| exemestane | 107868-30-4 | C20H24O2 | 296.41 | 1.56 |
|
| dienogest | 65928-58-7 | C20H25NO2 | 311.42 | 2.63 |
|
| pelitrexol | 446022-33-9 | C20H25N5O6S | 463.51 | 1.43 |
|
| trilostane | 13647-35-3 | C20H27NO3 | 329.44 | 4.01 |
|
| amsilarotene | 125973-56-0 | C20H27NO3Si2 | 385.61 | 4.73 |
|
| alitreninoin | 5300-03-8 | C20H28O2 | 300.44 | 6.30 |
|
| tretinoin | 302-79-4 | C20H28O2 | 300.44 | 6.30 |
|
| fluoxymesterone | 76-43-7 | C20H29FO3 | 336.45 | 3.36 |
|
| peretinoin | 81485-25-8 | C20H30O2 | 302.46 | 6.29 |
|
| dromostanolone; drostanolone | 58-19-5 | C20H32O2 | 304.47 | 3.76 |
|
| cedefingol | 35301-24-7 | C20H41NO3 | 343.55 | 6.53 |
|
| sorafenib | 284461-73-0 | C21H16ClF3N4O3 | 464.83 | 5.78 |
|
| diflomotecan | 220997-97-7 | C21H16F2N2O4 | 398.36 | 4.02 |
|
| (-)-Ci-cdp1 | 128050-92-0 | C21H18N4O3 | 374.40 | 3.51 |
|
| entinostat | 209783-80-2 | C21H20N4O3 | 376.42 | 3.15 |
|
| dovitinib | 405169-16-6 | C21H21FN6O | 392.44 | 3.34 |
|
| raltitrexed; Tomudex; ICI D1694 | 112887-68-0 | C21H22N4O6S | 458.49 | 2.45 |
|
| panobinostat | 404950-80-7 | C21H23N3O2 | 349.43 | 2.87 |
|
| pazopanib | 444731-52-6 | C21H23N7O2S | 437.53 | 0.51 |
|
| intoplicine | 125974-72-3 | C21H24N4O | 348.45 | 4.00 |
|
| teloxantrone | 91441-48-4 | C21H25N5O4 | 411.46 | 1.54 |
|
| ombrabulin | 181816-48-8 | C21H26N2O6 | 402.45 | 2.92 |
|
| toxipantrone | 156090-18-5 | C21H26N6O2 | 394.48 | 4.00 |
|
| plomestane | 77016-85-4 | C21H26O2 | 310.44 | 3.10 |
|
| ketotrexate | 52196-22-2 | C21H27N7O6 | 473.49 | -0.74 |
|
| aderbasib | 791828-58-5 | C21H28N4O5 | 416.48 | 3.21 |
|
| tosedostat | 238750-77-1 | C21H30N2O6 | 406.48 | 2.35 |
|
| calusterone | 17021-26-0 | C21H32O2 | 316.48 | 2.60 |
|
| indibulin | 204205-90-3 | C22H16ClN3O2 | 389.84 | 3.78 |
|
| rosabulin | 501948-05-6 | C22H16N4O2S | 400.46 | 2.02 |
|
| axitinib | 319460-85-0 | C22H18N4OS | 386.48 | 3.84 |
|
| (-)-epigallocatechin gallate | 989-51-5 | C22H18O11 | 458.37 | 2.54 |
|
| U-67786 | 105622-88-6 | C22H19N3O3 | 373.41 | 3.65 |
|
| bisantrene | 78186-34-2 | C22H22N8 | 398.47 | -0.83 |
|
| enpromate | 10087-89-5 | C22H23NO2 | 333.43 | 3.20 |
|
| erlotinib | 183321-74-6 | C22H23N3O4 | 393.44 | 3.41 |
|
| motesanib | 453562-69-1 | C22H23N5O | 373.46 | 3.27 |
|
| tylophorin deriv.; T-6888-019 | | C22H25NO4 | 367.44 | 3.29 |
|
| edatrexate | 80576-83-6 | C22H25N7O5 | 467.49 | -1.85 |
|
| dasatinib | 302962-49-8 | C22H26ClN7O2S | 488.01 | 2.03 |
|
| sunitinib | 557795-19-4 | C22H27FN4O2 | 398.48 | 2.76 |
|
| pazelliptine | 65222-35-7 | C22H27N5 | 361.49 | 3.01 |
|
| losoxantrone | 88303-60-0 | C22H27N5O4 | 425.49 | 4.06 |
|
| ametantrone | 64862-96-0 | C22H28N4O4 | 412.49 | 1.99 |
|
| banoxantrone | 136470-65-0 | C22H28N4O6 | 444.49 | 1.77 |
|
| mitoxantrone | 65271-80-9 | C22H28N4O6 | 444.49 | 1.62 |
|
| batimastat | 130370-60-4 | C22H29N3O4S2 | 463.62 | 1.42 |
|
| puromycin | 53-79-2 | C22H29N7O5 | 471.52 | -0.21 |
|
| salirasib | 162520-00-5 | C22H30O2S | 358.54 | 3.38 |
|
| megestrol | 3562-63-8 | C22H30O3 | 342.48 | 2.82 |
|
| terameprocol | 24150-24-1 | C22H30O4 | 358.48 | 3.96 |
|
| sobuzoxane | 98631-95-9 | C22H34N4O10 | 514.53 | 1.14 |
|
| annosquamosin A | 177742-55-1 | C22H34O4 | 362.50 | 3.84 |
|
| brequinar sodium | 96201-88-6 | C23H14F2NNaO2 | 397.36 | 5.64 |
|
| brequinar; DuP 785 | 96187-53-0 | C23H15F2NO2 | 375.37 | 4.31 |
|
| chlorotrianisene; Tace | 569-57-3 | C23H21ClO3 | 380.87 | 6.46 |
|
| tubulozole, | 84697-22-3 | C23H23Cl2N3O4S | 508.42 | 2.56 |
|
| crisnatol | 96389-68-3 | C23H23NO2 | 345.44 | 5.80 |
|
| pralatrexate | 146464-95-1 | C23H23N7O5 | 477.48 | -1.85 |
|
| topotecan hydrochloride | 119413-54-6 | C23H24ClN3O5 | 457.91 | 2.61 |
|
| estramustine phosphate disodium | 52205-73-9 | C23H30Cl2NNa2O6P | 564.35 | 1.00 |
|
| estramustine | 2998-57-4 | C23H31Cl2NO3 | 440.41 | 0.92 |
|
| mycophenolate mofetil | 128794-94-5 | C23H31NO7 | 433.50 | 3.00 |
|
| exatecan | 171335-80-1 | C24H22FN3O4 | 435.45 | 3.61 |
|
| pelitinib | 257933-82-7 | C24H23ClFN5O2 | 467.93 | 3.56 |
|
| olaparib | 763113-22-0 | C24H23FN4O3 | 434.47 | 4.34 |
|
| canertinib | 267243-28-7 | C24H25ClFN5O3 | 485.95 | 3.36 |
|
| metesind | 138384-68-6 | C24H25N3O3S | 435.55 | 2.01 |
|
| tylophorin | 482-20-2 | C24H27NO4 | 393.48 | 3.35 |
|
| bexarotene | 153559-49-0 | C24H28O2 | 348.48 | 2.17 |
|
| budotitane | 85969-07-9 | C24H28O6Ti | 460.38 | 2.85 |
|
| omtripolide | 195883-06-8 | C24H28O9 | 460.48 | 2.33 |
|
| daporinad | 201034-75-5 | C24H29N3O2 | 391.51 | 3.94 |
|
| ledoxantrone | 113457-05-9 | C24H34N5O2S | 424.57 | 2.81 |
|
| eptaloprost | 90693-76-8 | C24H34O5 | 402.53 | 1.82 |
|
| romidepsin | 128517-07-7 | C24H36N4O6S2 | 540.70 | -1.13 |
|
| carbetimer | 82230-03-3 | C24H37N5O8 | 523.59 | 1.03 |
|
| sizofiran | 9050-67-3 | C24H42O21 | 666.58 | -3.70 |
|
| streptonigrin; rufocromomycin | 3930-19-6 | C25H22N4O8 | 506.47 | 1.75 |
|
| mubritinib | 366017-09-6 | C25H23F3N4O2 | 468.48 | 2.44 |
|
| duocarmycin SA | 130288-24-3 | C25H23N3O7 | 477.47 | 5.71 |
|
| gimatecan | 292618-32-7 | C25H25N3O5 | 447.49 | 2.47 |
|
| belotecan | 256411-32-2 | C25H27N3O4 | 433.51 | 3.07 |
|
| retelliptine | 72238-02-9 | C25H32N4O | 404.56 | 4.37 |
|
| tilorone | 27591-97-5 | C25H34N2O3 | 410.56 | 3.83 |
|
| mepitiostane | 21362-69-6 | C25H40O2S | 404.66 | 3.96 |
|
| perifosine [inner salt] | 157716-52-4 | C25H52NO4P | 461.67 | 3.24 |
|
| lestaurtinib | 111358-88-4 | C26H21N3O4 | 439.47 | 3.90 |
|
| plevitrexed | 153537-73-6 | C26H25FN8O4 | 532.54 | 0.62 |
|
| cyclopropa[c]pyrrolo(3,2-e)indole deriv. | 134106-68-6 | C26H25N3O7 | 491.50 | 5.85 |
|
| duocarmycin A | 118292-34-5 | C26H25N3O8 | 507.50 | 4.79 |
|
| medorubicin | 64314-52-9 | C26H27NO10 | 513.50 | 1.27 |
|
| toremifene; chlorotamoxifen | 89778-26-7 | C26H28ClNO | 405.97 | 4.79 |
|
| annonidin B | 112710-70-0 | C26H28N2 | 368.51 | 3.96 |
|
| bosutinib | 380843-75-4 | C26H29Cl2N5O3 | 530.46 | 3.81 |
|
| danusertib | 827318-97-8 | C26H30N6O3 | 474.56 | 4.08 |
|
| fumagillin | 23110-15-8 | C26H34O7 | 458.55 | 6.29 |
|
| canfosfamide | 158382-37-7 | C26H40Cl4N5O10PS | 787.48 | 0.76 |
|
| sapacitabine | 151823-14-2 | C26H42N4O5 | 490.64 | 3.96 |
|
| ilmofosine | 83519-04-4 | C26H56NO5PS | 525.77 | 3.94 |
|
| inolitazone | 223132-37-4 | C27H26N4O4S | 502.59 | 3.80 |
|
| talotrexin | 113857-87-7 | C27H27N9O6 | 573.57 | -1.85 |
|
| esorubicin | 63521-85-7 | C27H29NO10 | 527.53 | 1.27 |
|
| lonafarnib | 193275-84-2 | C27H31Br2ClN4O2 | 638.84 | 3.10 |
|
| 5-iminodoxorubicin hydrochloride | 77331-69-2 | C27H31ClN2O10 | 579.00 | 1.27 |
|
| saracatinib | 379231-04-6 | C27H32ClN5O5 | 542.04 | 2.99 |
|
| patubilone; epothilone B | 152044-54-7 | C27H41NO6S | 507.69 | 4.21 |
|
| ixabepilone | 219989-84-1 | C27H42N2O5S | 506.71 | 3.86 |
|
| taltobulin | 228266-40-8 | C27H43N3O4 | 473.66 | 2.39 |
|
| elacytarabine | 188181-42-2 | C27H45N3O6 | 507.67 | 6.93 |
|
| emitefur | 110690-43-2 | C28H19FN4O8 | 558.48 | 3.27 |
|
| dynemicin Q | 138370-14-6 | C28H19NO9 | 513.46 | 1.27 |
|
| dynemicin P | 138370-13-5 | C28H21NO9 | 515.47 | 1.27 |
|
| nilotinib | 641571-10-0 | C28H22F3N7O | 529.53 | 1.66 |
|
| fosquidone | 114517-02-1 | C28H22NO6P | 499.46 | 4.73 |
|
| masitinib | 790299-79-5 | C28H30N6OS | 498.65 | 4.20 |
|
| dynemicin O | 138370-12-4 | C29H23NO10 | 545.50 | 1.27 |
|
| dynemicin M | 127003-54-7 | C29H23NO8 | 513.50 | 1.27 |
|
| lapatinib | 231277-92-2 | C29H26ClFN4O4S | 581.07 | 3.09 |
|
| edotecarin | 174402-32-5 | C29H28N4O11 | 608.56 | 2.62 |
|
| neratinib | 698387-09-6 | C29H30ClN5O4 | 548.04 | 3.89 |
|
| elomotecan | 220998-10-7 | C29H32ClN3O4 | 522.04 | 4.00 |
|
| miproxifene | 129612-87-9 | C29H35NO2 | 429.60 | 4.65 |
|
| xanthomycin A; guamecycline | 16545-11-2 | C29H38N8O8 | 626.67 | -1.08 |
|
| mofarotene | 125533-88-2 | C29H39NO2 | 433.64 | 1.94 |
|
| omacetaxine mepesuccinate | 26833-87-4 | C29H39NO9 | 545.63 | 2.46 |
|
| lexacalcitol | 131875-08-6 | C29H48O4 | 460.70 | 4.54 |
|
| hypericin | 548-04-9 | C30H16O8 | C30H16O8 | 2.69 |
|
| dynemicin A | 124412-57-3 | C30H19NO9 | 537.48 | 1.28 |
|
| adozelesin; U-73,975 | 110314-48-2 | C30H22N4O4 | 502.53 | 6.74 |
|
| dynemicin N | 127003-55-8 | C30H23NO10 | 557.51 | 1.27 |
|
| dynemicin H | 129985-03-1 | C30H23NO9 | 541.51 | 1.27 |
|
| U-68415 | 104713-40-8 | C30H23N5O3 | 501.55 | 6.82 |
|
| U-71184 | 101222-80-4 | C30H23N5O3 | 501.55 | 6.82 |
|
| bafetinib | 887650-05-7 | C30H31F3N8O | 576.63 | 2.26 |
|
| dofequidar | 129716-58-1 | C30H31N3O3 | 481.60 | 5.38 |
|
| toremifene citrate | 89778-27-8 | C30H32ClNO8 | 570.04 | 1.79 |
|
| balamapimod | 863029-99-6 | C30H32ClN7OS | 574.15 | 4.09 |
|
| galarubicin | 140637-86-1 | C30H32FNO13 | 633.58 | 1.27 |
|
| ispinesib | 336113-53-2 | C30H33ClN4O2 | 517.07 | 4.24 |
|
| brostallicin | 203258-60-0 | C30H35BrN12O5 | 723.60 | 1.25 |
|
| imatinib mesylate | 220127-57-1 | C30H35N7O4S | 589.72 | 2.81 |
|
| retaspimycin | 857402-23-4 | C30H43N3O8 | 573.69 | 1.87 |
|
| betulinic aldehyde | 13159-28-9 | C30H48O2 | 440.71 | 4.15 |
|
| oleanolic aldehyde | | C30H48O2 | 440.71 | 4.15 |
|
| ursolic aldehyde | | C30H48O2 | 440.71 | 4.15 |
|
| betulinic acid | 472-15-1 | C30H48O3 | 456.71 | 4.15 |
|
| ursolic acid | 77-52-1 | C30H48O3 | 456.71 | 4.15 |
|
| alphitolic acid | 19533-92-7 | C30H48O4 | 472.71 | 4.15 |
|
| corosolic acid | 4547-24-4 | C30H48O4 | 472.71 | 4.15 |
|
| maslinic acid | 4373-41-5 | C30H48O4 | 472.71 | 4.15 |
|
| betulin | 473-98-3 | C30H50O2 | 444.74 | 4.15 |
|
| elinafide | 162706-37-8 | C31H28N4O4 | 520.59 | 4.18 |
|
| tandutinib | 387867-13-2 | C31H42N6O4 | 562.71 | 2.72 |
|
| tanespimycin; allylaminogeldanamycin | 75747-14-7 | C31H43N3O8 | 585.70 | 0.67 |
|
| enocitabine | 55726-47-1 | C31H55N3O6 | 565.80 | 6.79 |
|
| (-)-Ci-cdp2 | 128049-56-9 | C32H26N6O4 | 558.60 | 5.91 |
|
| (+)-Ci-cdp2 | 128049-57-0 | C32H26N6O4 | 558.60 | 5.91 |
|
| enzastaurin | 170364-57-5 | C32H29N5O2 | 515.62 | 2.16 |
|
| zosuquidar | 167354-41-8 | C32H31F2N3O2 | 527.61 | 3.80 |
|
| elsamitrucin | 97068-30-9 | C32H33NO14 | 655.61 | 3.27 |
|
| pibrozelesin | 154889-68-6 | C32H36BrN5O8 | 698.58 | 2.50 |
|
| pibrozelesin hydrobromide | 148778-32-9 | C32H37Br2N5O8 | 779.49 | 1.86 |
|
| nemorubicin | 108852-90-0 | C32H37NO13 | 643.64 | 1.27 |
|
| sabarubicin | 211100-13-9 | C32H37NO13 | 643.64 | 1.27 |
|
| tallimustine | 115308-98-0 | C32H38Cl2N10O4 | 697.63 | 3.40 |
|
| irinotecan hydrochloride | 100286-90-6 | C32H39ClN4O6 | 611.14 | 4.45 |
|
| alvespimycin | 467214-20-6 | C32H48N4O8 | 616.76 | -0.31 |
|
| tasidotin | 192658-64-3 | C32H58N6O5 | 606.85 | -2.43 |
|
| dynemicin S | 132645-97-7 | C33H27NO11S | 645.64 | 1.27 |
|
| etalocib | 161172-51-6 | C33H33FO6 | 544.62 | 3.11 |
|
| becatecarin | 119673-08-4 | C33H34Cl2N4O7 | 669.56 | 4.14 |
|
| irinotecan | 97682-44-5 | C33H38N4O6 | 586.69 | 4.35 |
|
| detorubicin | 66211-92-5 | C33H39NO14 | 673.67 | 1.27 |
|
| disermolide; discodermolide | 127943-53-7 | C33H55NO8 | 593.80 | 5.80 |
|
| U-76074 | 119813-15-9 | C34H31N5O4 | 573.65 | 6.63 |
|
| elacridar | 143664-11-3 | C34H33N3O5 | 563.65 | 3.35 |
|
| berubicin | 677017-23-1 | C34H35NO11 | 633.65 | 1.27 |
|
| zorubicin | 54083-22-6 | C34H35N3O10 | 645.66 | 1.27 |
|
| valrubicin | 56124-62-0 | C34H36F3NO13 | 723.65 | 1.27 |
|
| biricodar | 159997-94-1 | C34H41N3O7 | 603.72 | 3.25 |
|
| fosfluridine tidoxil | 174638-15-4 | C34H62FN2O10PS | 740.91 | 3.75 |
|
| squalamine | 148717-90-2 | C34H65N3O5S | 627.97 | 4.15 |
|
| miriplatin | 141977-79-9 | C34H68N2O4Pt | 764.02 | 9.50 |
|
| U-78057; (+)-Cpi-cdpi2 | 114251-19-3 | C35H29N7O4 | 611.66 | 5.72 |
|
| midostaurin | 120685-11-2 | C35H30N4O4 | 570.65 | 4.20 |
|
| quarfloxin | 865311-47-3 | C35H33FN6O3 | 604.69 | 0.96 |
|
| MJE-3 | | C35H41N2O7 | 601.72 | 4.21 |
|
| cemadotin | 159776-69-9 | C35H56N6O5 | 640.87 | -1.72 |
|
| annonacin-10-one | 123266-21-7 | C35H62O7 | 594.86 | 9.96 |
|
| cohibin C | 189508-31-4 | C35H64O4 | 548.88 | 9.18 |
|
| cohibin D | 189508-32-5 | C35H64O4 | 548.88 | 9.17 |
|
| annonacin | 111035-65-5 | C35H64O7 | 596.88 | 9.48 |
|
| annonacin-A-one | 170900-30-8 | C35H64O7 | 596.88 | 10.09 |
|
| goniothalamicin | 113817-64-4 | C35H64O7 | 596.88 | 9.91 |
|
| goniothalamicinone | 170900-27-3 | C35H64O7 | 596.88 | 10.11 |
|
| annomuricin A, (C19/C20-erythro) | 167172-78-3 | C35H64O8 | 612.88 | 9.69 |
|
| annomuricin B, (C10/C11,C19/C20-erythro) | 167355-37-5 | C35H64O8 | 612.88 | 9.69 |
|
| annomuricin C, (all threo) | 167355-39-7 | C35H64O8 | 612.88 | 9.69 |
|
| annomuricin E | 205303-64-6 | C35H64O8 | 612.88 | 9.69 |
|
| muricapentocin | 205304-30-9 | C35H64O8 | 612.88 | 9.73 |
|
| (+)-Cbi-cdpi2 | 128300-15-2 | C36H28N6O4 | 608.66 | 6.79 |
|
| dexniguldipine | 120054-86-6 | C36H39N3O6 | 609.72 | 2.20 |
|
| laniquidar | 197509-46-9 | C37H36N4O3 | 584.72 | 5.11 |
|
| aristoforin | 849215-53-8 | C37H54O6 | 594.83 | 2.97 |
|
| annonin VI | 129212-94-8 | C37H66O7 | 622.92 | 10.0 |
|
| bullatacin | 102989-24-2 | C37H66O7 | 622.92 | 9.98 |
|
| gigantetronenin | 145403-31-2 | C37H66O7 | 622.92 | 8.67 |
|
| gigantetroneninone | 177535-01-2 | C37H66O7 | 622.92 | 9.85 |
|
| annomontacin | 137550-92-6 | C37H68O7 | 624.93 | 9.97 |
|
| tariquidar | 206873-63-4 | C38H38N4O6 | 646.74 | 3.19 |
|
| nogalamycin | 1404-15-5 | C39H49NO16 | 787.81 | 2.20 |
|
| bietaserpine | 53-18-9 | C39H53N3O9 | 707.86 | 2.76 |
|
| soblitodin | 149606-27-9 | C39H67N5O6 | 701.99 | -1.48 |
|
| squamocin | 120298-30-8 | C39H70O5 | 618.97 | 9.79 |
|
| streptovarycin | 1404-74-6 | C40H51NO14 | 769.84 | 1.87 |
|
| carfilzomib | 868540-17-4 | C40H57N5O7 | 719.92 | -1.34 |
|
| eribulin | 253128-41-5 | C40H61NO11 | 731.92 | 5.40 |
|
| bistramid A; bistratene A | 115566-02-4 | C40H68N2O8 | 704.99 | 5.40 |
|
| carzelesin | 119813-10-4 | C41H37ClN6O5 | 729.24 | 2.90 |
|
| lapatinib ditosylate [monohydrate ] | 388082-78-8 | C41H38ClFN4O10S3 | 897.42 | -2.16 |
|
| atrimustine | 75219-46-4 | C41H47Cl2NO6 | 720.73 | 1.58 |
|
| bizelesin | 129655-21-6 | C43H36Cl2N8O5 | 815.72 | -0.77 |
|
| timcodar | 179033-51-3 | C43H45ClN4O6 | 749.31 | 4.82 |
|
| vindesine | 53643-48-4 | C43H55N5O7 | 753.94 | 1.39 |
|
| milataxel | 393101-41-2 | C44H55NO16 | 853.91 | 2.00 |
|
| ortataxel | 186348-23-2 | C44H57NO17 | 871.93 | 2.00 |
|
| afeletecan | 215604-75-4 | C45H49N7O11S | 895.99 | 1.21 |
|
| larotaxel | 156294-36-9 | C45H53NO14 | 831.91 | 1.99 |
|
| vinflunine | 162652-95-1 | C45H54F2N4O8 | 816.94 | 1.38 |
|
| vinorelbine [base] | 71486-22-1 | C45H54N4O8 | 778.95 | 1.18 |
|
| cabazitaxel | 183133-96-2 | C45H57NO14 | 835.94 | 2.20 |
|
| vinformide | 54022-49-0 | C46H54N4O10 | 822.96 | 1.33 |
|
| vinepidine | 68170-69-4 | C46H56N4O9 | 808.97 | 2.69 |
|
| vinleurosine | 23360-92-1 | C46H56N4O9 | 808.97 | 1.35 |
|
| simotaxel | 791635-59-1 | C46H57NO15S | 896.02 | 2.00 |
|
| tesetaxel | 333754-36-2 | C46H60FN3O13 | 368.40 | 2.59 |
|
| vinzolidine | 67699-40-5 | C48H56ClN5O9 | 882.45 | 1.40 |
|
| motexafin | 189752-49-6 | C48H67N5O10 | 874.09 | 2.27 |
|
| octreotide | 83150-76-9 | C49H66N10O10S2 | 1019.26 | -0.99 |
|
| paclitaxel ceribate | 186040-50-6 | C51H57NO18 | 972.01 | 1.91 |
|
| vinleucinol | 81571-28-0 | C51H69N5O9 | 896.14 | 3.69 |
|
| vinfosiltine | 123286-00-0 | C51H72N5O10P | 946.14 | 2.73 |
|
| plicamycin; mithramycin; aurelic acid | 18378-89-7 | C52H76O24 | 1085.16 | 1.70 |
|
| deforolimus | 572924-54-0 | C53H84NO14P | 990.22 | 2.29 |
|
| calicheamicin gamma(1)I | 108212-75-5 | C55H74IN3O21S4 | 1368.35 | 2.24 |
|
| vintriptol | 81600-06-8 | C56H68N6O9 | 969.19 | 1.63 |
|
| vapreotide | 103222-11-3 | C57H70N12O9S2 | 1131.39 | 0.56 |
|
| leuprorelin; leuprorelide | 53714-56-0 | C57H80N16O12 | 1181.37 | 2.16 |
|
| plitidepsin | 137219-37-5 | C57H87N7O15 | 1110.36 | -0.32 |
|
| bleomycin A2 [sulfate] | 11056-06-7 | C58H84N17O21S3 | 1415.56 | 3.74 |
|
| marinomycin A | | C59H78O14 | 1011.26 | 4.90 |
|
| leuprolide acetate | 74381-53-6 | C59H84N16O14 | 1241.42 | 2.16 |
|
| mifamurtide | 83461-56-7 | C59H109N6O19P | 1237.52 | 1.29 |
|
| buserelin | 57982-77-1 | C60H86N16O13 | 1239.45 | 2.16 |
|
| peplomycin | 68247-85-8 | C61H88N18O21S2 | 1473.61 | -0.46 |
|
| valspodar | 121584-18-7 | C63H111N11O12 | 1214.65 | -0.32 |
|
| triptorelin | 57773-63-4 | C64H82N18O13 | 1311.47 | -0.97 |
|
| edotreotide | 204318-14-9 | C65H92N14O18S2 | 1421.66 | -0.32 |
|
| talisomycin | 65057-90-1 | C68H110N22O27S2 | 1731.88 | 2.15 |
|
|