Hyualuronan lyase inhibitoros [selection]

TerraQSAR-LOGPTM computed octanol/water partition coefficients (CLOGPs).


For other toxicity and effect values, such as mammalian (rat/mouse) intravenous LD50, mammalian (rat/mouse) oral LD50,
Daphnia magna 48-hr LC50, fish (fathead minnow) 96-hr LC50, estrogen receptor binding affinity (RBA), skin irritation potential,
use TerraQSAR-RMIV, TerraQSAR-OMAR, TerraQSAR-Daphnia, TerraQSAR-FHM, TerraQSAR-E2-RBA, or TerraQSAR-SKIN programs,


NAME / SMILES CAS FORMULA MWTerraQSAR - LOGP
isophthalic acid 121-91-5 C8H6O4 166.13
1.46
terephthalic acid 100-21-0 C8H6O4 166.13
1.46
indole-2-carboxylic acid 1477-50-5 C9H7NO2 161.16
2.31
kynurenic acid 492-27-3 C10H7NO3 189.17
0.66
1,4-benzenediacetic acid 7325-46-4 C10H10O4 194.19
1.63
methyl 3-isoquinolinecarboxylate 27104-73-0 C11H9NO2 187.20
1.12
2,8-dinitrodibenzofuran 144280-50-2 C12H6N2O5 258.19
2.43
4-benzoylbenzoic acid 611-95-0 C14H10O3 226.23
2.59
diphenylmethylene(methoxyimine) 3376-34-9 C14H13NO 211.26
3.66
N,N-diphenylacetamide 519-87-9 C14H13NO 211.26
3.62
(3E)-4-(1,2-dimethyl-5-nitro-1H-indol-3-yl)but-3-en-2-one 133414-98-9 C14H14N2O3 258.28
2.51
2,8-dinitrodibenzofuran 144280-50-2 C12H6N2O5 258.19
2.43
4-benzoylbenzoic acid 611-95-0 C14H10O3 226.23
2.59
diphenylmethylene(methoxyimine) 3376-34-9 C14H13NO 211.26
3.66
N,N-diphenylacetamide 519-87-9 C14H13NO 211.26
3.62


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