UCSF

ZINC06786590

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2006 30 No

Popular Name: 5-(3,4-dimethoxyphenyl)-1-(2-hydroxyethyl)-4-[hydroxy-(4-methoxyphenyl)-methylene]-pyrrolidine-2,3-d 5-(3,4-dimethoxyphenyl)-1-(2-hyd…

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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) 1.45 3.85 -62.02 1 8 -1 108 412.418 8 ↓
Mid Mid (pH 6-8) 1.90 2.53 -15.44 2 8 0 106 413.426 7 ↓
Mid Mid (pH 6-8) 0.87 3.7 -17.32 1 8 0 102 413.426 8 ↓

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