UCSF

ZINC16729924

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 6th, 2008 39 No

Popular Name: (5S)-1-(3-diethylaminopropyl)-3-hydroxy-5-(4-pentoxyphenyl)-4-(4-propoxybenzoyl)-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) 6.37 15.48 -76.8 1 7 0 83 536.713 17 ↓
Mid Mid (pH 6-8) 6.81 14.37 -59.71 2 7 1 81 537.721 16 ↓
Mid Mid (pH 6-8) 5.78 15.34 -63.47 1 7 1 77 537.721 17 ↓

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