UCSF

ZINC09186774

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 13th, 2007 33 No

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

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Other Names:

MFCD03288069

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) 4.54 11.05 -63.96 0 6 -1 79 442.491 8 ↓
Mid Mid (pH 6-8) 3.96 0.86 -14.06 0 6 0 72 443.499 8 ↓
Lo Low (pH 4.5-6) 4.54 10.23 -16.6 1 6 0 76 443.499 8 ↓

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