UCSF

ZINC33444990

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 9th, 2009 38 No

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

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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) 4.17 12.73 -44.04 0 7 -1 92 505.55 9 ↓
Lo Low (pH 4.5-6) 4.17 11.6 -23.36 1 7 0 89 506.558 9 ↓
Lo Low (pH 4.5-6) 4.17 12.04 -54.09 2 7 1 90 507.566 9 ↓

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

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