UCSF

ZINC09379795

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2007 30 No

Popular Name: 5-(3,4-dichlorophenyl)-3-hydroxy-4-(4-methoxybenzoyl)-1-(3-methoxypropyl)-1,5-dihydro-2H-pyrrol-2-one 5-(3,4-dichlorophenyl)-3-hydroxy…

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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) 3.97 8.58 -38.13 0 6 -1 79 449.31 8 ↓
Mid Mid (pH 6-8) 4.42 7.55 -29.74 1 6 0 76 450.318 7 ↓
Mid Mid (pH 6-8) 3.39 -0.49 -24.37 0 6 0 72 450.318 8 ↓

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