UCSF

ZINC17209287

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2008 33 No

Popular Name: 4-[(E)-[(2S)-2-(3-chlorophenyl)-1-(3-methoxypropyl)-4,5-dioxo-pyrrolidin-3-ylidene]-hydroxy-methyl]- 4-[(E)-[(2S)-2-(3-chlorophenyl)-…

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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) 2.60 6.96 -55.85 0 8 -1 107 491.973 9 ↓
Mid Mid (pH 6-8) 3.05 6.68 -17.29 1 8 0 104 492.981 8 ↓
Mid Mid (pH 6-8) 2.02 6.65 -17.03 0 8 0 101 492.981 9 ↓

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