UCSF

ZINC09359277

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 23rd, 2007 29 No

Popular Name: 5-(4-bromophenyl)-3-hydroxy-1-(2-methoxyethyl)-4-(4-methoxy-3-methyl-benzoyl)-5H-pyrrol-2-one 5-(4-bromophenyl)-3-hydroxy-1-(2…

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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) 3.60 8.55 -41.11 0 6 -1 79 459.316 7 ↓
Mid Mid (pH 6-8) 3.02 -0.6 -21.91 0 6 0 72 460.324 7 ↓
Mid Mid (pH 6-8) 4.05 7.28 -29.58 1 6 0 76 460.324 6 ↓

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