UCSF

ZINC09060519

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 7th, 2007 31 No

Popular Name: 4-(2-furylcarbonyl)-3-hydroxy-1-(2-hydroxyethyl)-5-(4-isopentyloxy-3-methoxy-phenyl)-5H-pyrrol-2-one 4-(2-furylcarbonyl)-3-hydroxy-1-…

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Download: MOL2 SDF SMILES Flexibase

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) 2.30 7.13 -47.1 1 8 -1 112 428.461 10 ↓
Mid Mid (pH 6-8) 1.72 5.92 -28.86 1 8 0 106 429.469 10 ↓
Mid Mid (pH 6-8) 2.75 5.3 -27.22 2 8 0 109 429.469 9 ↓

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