UCSF

ZINC05409051

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 1st, 2006 27 No

Popular Name: 5-(2-chlorophenyl)-3-hydroxy-1-(2-hydroxypropyl)-4-(4-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-one 5-(2-chlorophenyl)-3-hydroxy-1-(…

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Other Names:

MFCD03274577

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) 3.19 7.41 -44.12 1 5 -1 81 384.839 5 ↓
Mid Mid (pH 6-8) 2.60 -1.87 -16.54 1 5 0 74 385.847 5 ↓
Mid Mid (pH 6-8) 3.63 6.12 -23.42 2 5 0 78 385.847 4 ↓

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