UCSF

ZINC06499114

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 3rd, 2006 34 No

Popular Name: 5-(4-ethoxy-3-methoxy-phenyl)-3-hydroxy-4-(3-methoxybenzoyl)-1-(5-methylisoxazol-3-yl)-5H-pyrrol-2-o 5-(4-ethoxy-3-methoxy-phenyl)-3-…

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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) 2.96 10.25 -68.87 0 9 -1 114 463.466 8 ↓
Mid Mid (pH 6-8) 3.41 8.39 -35.52 1 9 0 111 464.474 7 ↓
Mid Mid (pH 6-8) 2.38 9.42 -26.03 0 9 0 108 464.474 8 ↓

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