UCSF

ZINC09361094

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 23rd, 2007 34 No

Popular Name: 5-(3-ethoxy-4-hydroxy-phenyl)-4-[hydroxy-(4-isobutoxyphenyl)-methylene]-1-(2-methoxyethyl)pyrrolidin 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) 3.26 7.35 -65.58 1 8 -1 108 468.526 11 ↓
Mid Mid (pH 6-8) 3.70 6.94 -23.28 2 8 0 106 469.534 10 ↓
Mid Mid (pH 6-8) 2.67 -1.43 -14.62 1 8 0 102 469.534 11 ↓

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