UCSF

ZINC08779158

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 27th, 2007 36 No

Popular Name: 3-hydroxy-4-(4-isopropoxybenzoyl)-5-(4-nitrophenyl)-1-(2-piperazin-1-ylethyl)-5H-pyrrol-2-one 3-hydroxy-4-(4-isopropoxybenzoyl…

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Annotations

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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) 2.46 9.55 -138.67 4 10 2 134 496.564 9 ↓
Mid Mid (pH 6-8) 1.88 10.22 -149.83 3 10 2 131 496.564 9 ↓

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