| NAME | CAS | FORMULA | MW | TerraQSAR - LOGP |
| 6-methoxy-2-naphthylacetic acid | 23981-47-7 | C12H10O3 | 202.21 | 3.19 |
|
| valeryl salicylate | 64206-54-8 | C12H14O4 | 222.24 | 1.19 |
|
| niflumic acid | 4394-00-7 | C13H9F3N2O2 | 282.22 | 5.23 |
|
| ebselen | 60940-34-3 | C13H9NOSe | 274.18 | 1.63 |
|
| nimesulide | 51803-78-2 | C13H12N2O5S | 308.31 | 2.54 |
|
| NS-398 | 123653-11-2 | C13H18N2O5S | 314.36 | 1.64 |
|
| ibuprofen (+/-) | 15687-27-1 | C13H18O2 | 206.28 | 3.97 |
|
| tenidap; CAS also 120240-48-2 | 100599-27-7 | C14H9ClN2O3S | 320.75 | 2.56 |
|
| diclofenac-sodium | 15307-79-6 | C14H10Cl2NNaO2 | 318.13 | 0.70 |
|
| meclofenamate-sodium salt | 6385-02-0 | C14H10Cl2NNaO2 | 318.13 | 3.41 |
|
| diclofenac [acid] | 15307-86-5 | C14H11Cl2NO2 | 296.15 | 3.41 |
|
| tolfenamic acid | 13710-19-5 | C14H12ClNO2 | 261.71 | 4.36 |
|
| resveratroll | 501-36-0 | C14H12O3 | 228.25 | 2.33 |
|
| piceatannol | 4339-71-3 | C14H12O4 | 244.25 | 2.33 |
|
| meloxicam | 71125-38-7 | C14H13N3O4S2 | 351.40 | 2.62 |
|
| isoxicam | 34552-84-6 | C14H13N3O5S | 335.34 | 1.02 |
|
| naproxen; Naprosyn | 22204-53-1 | C14H14O3 | 230.26 | 3.18 |
|
| lumiracoxib; COX-189; Prexige | 220991-20-8 | C15H13ClFNO2 | 293.72 | 3.04 |
|
| flurbiprofen (±) | 51543-38-5 | C15H13FO2 | 244.26 | 3.90 |
|
| piroxicam | 36322-90-4 | C15H13N3O4S | 331.35 | 3.06 |
|
| zomepirac; CAS also 64092-48-4 | 33369-31-2 | C15H14ClNO3 | 291.73 | 1.81 |
|
| fenspiride | 5053-06-5 | C15H20N2O2 | 260.34 | 2.60 |
|
| mavacocib | 170569-88-7 | C16H11F4N3O2S | 385.34 | 6.18 |
|
| cimicoxib | 265114-23-6 | C16H13ClFN3O3S | 381.81 | 1.27 |
|
| flosulide | 80937-31-1 | C16H13F2NO4S | 353.34 | 2.01 |
|
| robenacoxib | 220991-32-2 | C16H13F4NO2 | 327.28 | 2.66 |
|
| valdecoxib; Bextra | 181695-72-7 | C16H14N2O3S | 314.36 | 0.96 |
|
| tilmacoxib | 180200-68-4 | C16H19FN2O3S | 338.40 | 1.66 |
|
| DuP-697 | 88149-94-4 | C17H12BrFO2S2 | 411.32 | 0.51 |
|
| enolicam | 59755-82-7 | C17H12Cl3NO4S | 432.71 | 2.58 |
|
| SC-58125 | 162054-19-5 | C17H12F4N2O2S | 384.35 | 0.76 |
|
| celecoxib; celebrex | 169590-42-5 | C17H14F3N3O2S | 381.38 | 1.19 |
|
| deracoxib | 169590-41-4 | C17H14F3N3O3S | 397.37 | 1.32 |
|
| oxindanac | 68548-99-2 | C17H14O4 | 282.29 | 3.14 |
|
| MK-0966 | 186912-82-3 | C17H14O4S | 314.36 | 0.57 |
|
| rofecoxib | 162011-90-7 | C17H14O4S | 314.36 | 0.57 |
|
| indoprofen | 31842-01-0 | C17H15NO3 | 281.31 | 2.90 |
|
| trismethoxy resveratrol | 22255-22-7 | C17H18O3 | 270.33 | -0.27 |
|
| firocoxib; Previcox | 189954-96-9 | C17H20O5S | 336.41 | 2.25 |
|
| etoricoxib | 202409-33-4 | C18H15ClN2O2S | 358.85 | 1.23 |
|
| (E)-3,3',4,5'-tetramethoxystilbene | 83088-26-0 | C18H20O4 | 300.35 | -0.30 |
|
| indomethacin; indometacin | 53-86-1 | C19H16ClNO4 | 357.79 | 4.27 |
|
| parecoxib | 198470-84-7 | C19H18N2O4S | 370.43 | 0.97 |
|
| phenylbutazone; Butazolidin | 50-33-9 | C19H20N2O2 | 308.38 | 3.16 |
|
| apricoxib | 197904-84-0 | C19H20N2O3S | 356.44 | 1.93 |
|
| sulindac sulfide | 32004-67-4 | C20H17FO2S | 340.42 | 2.19 |
|
| sulindac sulfone | 59864-04-9 | C20H17FO4S | 372.41 | 0.55 |
|
| 5,8,11,14-eicosatetraynoic acid | 1191-85-1 | C20H24O2 | 296.41 | 2.15 |
|
| 8,11-eicosadiynoic acid | 82073-91-4 | C20H32O2 | 304.47 | 6.08 |
|
| curcumin | 458-37-7 | C21H20O6 | 368.38 | 2.30 |
|
| melitracene; melitracen | 5118-29-6 | C21H25N | 291.44 | 3.65 |
|
| harpagoside | 19210-12-9 | C24H30O11 | 494.49 | 0.96 |
|
| pamicogrel | 101001-34-7 | C25H24N2O4S | 448.54 | 3.76 |
|