UCSF

ZINC17778204

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 25th, 2008 27 No

Popular Name: (4E,5R)-5-(4-chlorophenyl)-1-(2-hydroxyethyl)-4-[hydroxy-(4-methoxyphenyl)methylene]pyrrolidine-2,3- (4E,5R)-5-(4-chlorophenyl)-1-(2-…

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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) 2.48 4.57 -62.21 1 6 -1 90 386.811 6 ↓
Mid Mid (pH 6-8) 1.90 5.41 -10.73 1 6 0 84 387.819 6 ↓
Mid Mid (pH 6-8) 2.48 5.03 -11.89 2 6 0 87 387.819 6 ↓

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