UCSF

ZINC01132357

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 8th, 2004 32 No

Popular Name: (4S)-6-amino-3-(2,5-dimethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,4-dihydropyrano[2,3-c]pyrazole- (4S)-6-amino-3-(2,5-dimethoxyphe…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.81 4.86 -11.69 3 7 0 106 442.397 5 ↓
Lo Low (pH 4.5-6) 3.81 5.23 -61.47 4 7 1 108 443.405 5 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.