UCSF

ZINC06566061

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2006 36 No

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

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Vendors

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) 2.89 0.37 -54.53 2 10 1 126 496.54 9 ↓
Mid Mid (pH 6-8) 3.34 -0.04 -66.55 2 10 1 126 496.54 8 ↓
Mid Mid (pH 6-8) 2.31 0.32 -64.2 1 10 1 123 496.54 9 ↓

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