UCSF

ZINC17146769

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 16th, 2008 36 No

Popular Name: 5-(2,5-dimethoxyphenyl)-3-hydroxy-4-(4-methoxy-2-methylbenzoyl)-1-[2-(4-morpholinyl)ethyl]-1,5-dihydro-2H-pyrrol-2-one 5-(2,5-dimethoxyphenyl)-3-hydrox…

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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) 2.73 7.71 -44.25 0 9 -1 101 495.552 9 ↓
Mid Mid (pH 6-8) 3.17 8.01 -50.21 2 9 1 99 497.568 8 ↓
Mid Mid (pH 6-8) 2.15 9.87 -49.57 1 9 1 96 497.568 9 ↓
Mid Mid (pH 6-8) 2.73 10.06 -52.15 1 9 0 102 496.56 9 ↓

Activity (Go SEA)

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