UCSF

ZINC13549197

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2008 32 No

Popular Name: 4-(4-butoxy-3-methylbenzoyl)-5-(4-chlorophenyl)-3-hydroxy-1-(2-methoxyethyl)-1,5-dihydro-2H-pyrrol-2-one 4-(4-butoxy-3-methylbenzoyl)-5-(…

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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) 4.91 10.68 -59.68 0 6 -1 79 456.946 10 ↓
Mid Mid (pH 6-8) 5.36 10.88 -14.78 1 6 0 76 457.954 9 ↓
Mid Mid (pH 6-8) 4.33 10.91 -12.51 0 6 0 73 457.954 10 ↓

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