UCSF

ZINC06238996

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2006 29 No

Popular Name: 4-[(4-chlorophenyl)-hydroxy-methylene]-5-(4-hydroxy-3-methoxy-phenyl)-1-(2-methoxyethyl)pyrrolidine- 4-[(4-chlorophenyl)-hydroxy-meth…

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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) 2.38 5.33 -61.75 1 7 -1 99 416.837 7 ↓
Mid Mid (pH 6-8) 2.83 -1.54 -22.78 2 7 0 96 417.845 6 ↓
Mid Mid (pH 6-8) 1.80 -2.04 -14.76 1 7 0 93 417.845 7 ↓

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