UCSF

ZINC09414430

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2007 33 No

Popular Name: 5-(3-ethoxy-4-hydroxy-phenyl)-4-[hydroxy-(4-isopropoxyphenyl)-methylene]-1-(2-methoxyethyl)pyrrolidi 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) 2.87 6.52 -65.38 1 8 -1 108 454.499 10 ↓
Mid Mid (pH 6-8) 2.29 -1.55 -15.19 1 8 0 102 455.507 10 ↓
Mid Mid (pH 6-8) 3.32 5.94 -22.32 2 8 0 106 455.507 9 ↓

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