UCSF

ZINC09358047

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 23rd, 2007 35 No

Popular Name: 5-(3-ethoxy-4-hydroxy-phenyl)-4-[hydroxy-(4-isobutoxyphenyl)-methylene]-1-(3-methoxypropyl)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) 3.53 8.06 -62.31 1 8 -1 108 482.553 12 ↓
Mid Mid (pH 6-8) 2.94 -1.21 -14.22 1 8 0 102 483.561 12 ↓
Mid Mid (pH 6-8) 3.97 7.31 -21.28 2 8 0 106 483.561 11 ↓

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