UCSF

ZINC33819069

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 20th, 2009 34 No

Popular Name: (2R)-2-[[4-[4-[(4-chlorophenyl)methyl]-1-piperidyl]phenoxy]methyl]-2-methyl-6-nitro-3H-imidazo[2,1-b (2R)-2-[[4-[4-[(4-chlorophenyl)m…

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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) 5.79 14.96 -90.42 2 8 2 88 484.984 7 ↓
Mid Mid (pH 6-8) 5.79 13.86 -57.81 1 8 1 87 483.976 7 ↓
Mid Mid (pH 6-8) 5.79 13.19 -20.96 0 8 0 85 482.968 7 ↓
Mid Mid (pH 6-8) 5.79 14.29 -40.34 1 8 1 87 483.976 7 ↓

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Rings

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

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