UCSF

ZINC16700988

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 5th, 2008 33 No

Popular Name: (5R)-4-(4-butoxy-3-methyl-benzoyl)-3-hydroxy-1-(3-methoxypropyl)-5-(p-tolyl)-5H-pyrrol-2-one (5R)-4-(4-butoxy-3-methyl-benzoy…

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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) 4.95 11.93 -42.72 0 6 -1 79 450.555 11 ↓
Mid Mid (pH 6-8) 5.40 10.43 -26.85 1 6 0 76 451.563 10 ↓
Mid Mid (pH 6-8) 4.37 11.41 -20.3 0 6 0 73 451.563 11 ↓

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