UCSF

ZINC36360242

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2009 29 Yes

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

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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) 3.11 5.88 -11.88 2 6 0 80 403.36 4 ↓
Ref Reference (pH 7) 2.93 8.55 -12.63 2 6 0 76 403.36 4 ↓
Lo Low (pH 4.5-6) 2.93 9 -48.24 3 6 1 78 404.368 4 ↓

Activity (Go SEA)

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