UCSF

ZINC36359004

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2009 27 Yes

Popular Name: (7S)-7-(3-hydroxy-4-methoxy-phenyl)-3-(3-methoxyphenyl)-6,7-dihydro-4H-imidazo[4,5-b]pyridin-5-one (7S)-7-(3-hydroxy-4-methoxy-phen…

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Download: MOL2 SDF SMILES Flexibase

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) 2.27 4.17 -12.94 2 7 0 89 365.389 4 ↓
Ref Reference (pH 7) 2.09 6.84 -12.8 2 7 0 86 365.389 4 ↓
Lo Low (pH 4.5-6) 2.09 7.3 -44.98 3 7 1 87 366.397 4 ↓

Activity (Go SEA)

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