UCSF

ZINC09272722

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2007 37 No

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

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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) 4.35 12.85 -54.37 0 9 -1 125 501.515 10 ↓
Mid Mid (pH 6-8) 3.77 0.99 -21.05 0 9 0 118 502.523 10 ↓
Mid Mid (pH 6-8) 4.80 11.6 -29.29 1 9 0 122 502.523 9 ↓

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