UCSF

ZINC09328898

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 18th, 2007 34 No

Popular Name: 5-(3-ethoxy-4-hydroxy-phenyl)-4-[(4-ethoxyphenyl)-hydroxy-methylene]-1-(5-methylisoxazol-3-yl)-pyrro 5-(3-ethoxy-4-hydroxy-phenyl)-4-…

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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) 3.05 8.48 -58.37 1 9 -1 125 463.466 8 ↓
Mid Mid (pH 6-8) 2.47 0.27 -18.11 1 9 0 119 464.474 8 ↓
Mid Mid (pH 6-8) 3.50 7.79 -18.32 2 9 0 122 464.474 7 ↓

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