UCSF

ZINC17993864

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2008 30 No

Popular Name: 4-benzoyl-3-hydroxy-5-(4-methylphenyl)-1-(2-morpholin-4-ylethyl)-1,5-dihydro-2H-pyrrol-2-one 4-benzoyl-3-hydroxy-5-(4-methylp…

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Other Names:

MFCD02229739

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) 2.70 7.6 -60.33 0 6 -1 73 405.474 6 ↓
Mid Mid (pH 6-8) 2.12 10.32 -47.62 1 6 1 68 407.49 6 ↓
Mid Mid (pH 6-8) 2.70 9.94 -73.23 1 6 0 74 406.482 6 ↓

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