UCSF

ZINC20134089

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2008 32 No

Popular Name: (5S)-5-(4-chlorophenyl)-1-(3-diethylaminopropyl)-3-hydroxy-4-(3-methoxybenzoyl)-5H-pyrrol-2-one (5S)-5-(4-chlorophenyl)-1-(3-die…

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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) 4.14 12 -77.31 1 6 0 74 456.97 10 ↓
Lo Low (pH 4.5-6) 4.14 11.17 -55.41 2 6 1 71 457.978 10 ↓

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