UCSF

ZINC11914616

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 15th, 2008 30 No

Popular Name: (5S)-3-hydroxy-1-(2-hydroxyethyl)-4-(4-isobutoxybenzoyl)-5-(p-tolyl)-5H-pyrrol-2-one (5S)-3-hydroxy-1-(2-hydroxyethyl…

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Download: MOL2 SDF SMILES Flexibase

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) 3.37 -1.33 -12.54 2 6 0 87 409.482 8 ↓
Mid Mid (pH 6-8) 2.79 -1.43 -18.3 1 6 0 84 409.482 8 ↓

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