UCSF

ZINC09046531

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2007 32 No

Popular Name: 5-(3-ethoxy-4-hydroxy-phenyl)-4-[hydroxy-(4-methoxyphenyl)-methylene]-1-(3-methoxypropyl)pyrrolidine 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) 2.40 5.24 -64.44 1 8 -1 108 440.472 10 ↓
Mid Mid (pH 6-8) 1.82 5.62 -14.78 1 8 0 102 441.48 10 ↓
Mid Mid (pH 6-8) 2.85 4.06 -20.86 2 8 0 106 441.48 9 ↓

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