UCSF

ZINC36360462

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Substance Information

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

Popular Name: (7R)-3-(4-fluorophenyl)-7-(3,4,5-trimethoxyphenyl)-6,7-dihydro-4H-imidazo[4,5-b]pyridin-5-one (7R)-3-(4-fluorophenyl)-7-(3,4,5…

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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) 2.49 6.94 -13.53 1 7 0 78 397.406 5 ↓
Ref Reference (pH 7) 2.30 9.59 -14.33 1 7 0 75 397.406 5 ↓
Lo Low (pH 4.5-6) 2.30 10.05 -53.48 2 7 1 76 398.414 5 ↓

Activity (Go SEA)

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