UCSF

ZINC08438676

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 15th, 2006 29 No

Popular Name: 4-(4-bromobenzoyl)-3-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-methylphenyl)-1,5-dihydro-2H-pyrrol-2-one 4-(4-bromobenzoyl)-3-hydroxy-1-[…

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Other Names:

MFCD03779453

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) 2.89 6.8 -62.49 1 6 -1 90 459.316 8 ↓
Mid Mid (pH 6-8) 3.34 -3.94 -32 2 6 0 87 460.324 7 ↓
Mid Mid (pH 6-8) 2.31 -3.7 -22.91 1 6 0 83 460.324 8 ↓

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