UCSF

ZINC16729912

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 6th, 2008 37 No

Popular Name: (5S)-1-(3-diethylaminopropyl)-3-hydroxy-4-(4-propoxybenzoyl)-5-(4-propoxyphenyl)-5H-pyrrol-2-one (5S)-1-(3-diethylaminopropyl)-3-…

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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) 5.30 14.24 -75.35 1 7 0 83 508.659 15 ↓
Mid Mid (pH 6-8) 5.75 13.1 -59.04 2 7 1 81 509.667 14 ↓
Mid Mid (pH 6-8) 4.72 14.09 -62.42 1 7 1 77 509.667 15 ↓

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