UCSF

ZINC09243645

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2007 34 No

Popular Name: 4-[(4-butoxyphenyl)-hydroxy-methylene]-1-(3-dimethylaminopropyl)-5-(2-methoxyphenyl)-pyrrolidine-2,3 4-[(4-butoxyphenyl)-hydroxy-meth…

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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) 4.18 11.91 -76.11 1 7 0 83 466.578 12 ↓
Mid Mid (pH 6-8) 4.63 12.33 -48.52 2 7 1 81 467.586 11 ↓
Mid Mid (pH 6-8) 3.60 2.57 -44.63 1 7 1 77 467.586 12 ↓

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