UCSF

ZINC19898492

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2008 30 No

Popular Name: 4-benzoyl-5-(3-fluorophenyl)-3-hydroxy-1-[2-(4-morpholinyl)ethyl]-1,5-dihydro-2H-pyrrol-2-one 4-benzoyl-5-(3-fluorophenyl)-3-h…

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Other Names:

MFCD02229746

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) 2.39 6.66 -56.62 0 6 -1 73 409.437 6 ↓
Mid Mid (pH 6-8) 2.39 9 -69.03 1 6 0 74 410.445 6 ↓
Lo Low (pH 4.5-6) 2.39 8.17 -51.74 2 6 1 71 411.453 6 ↓

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