UCSF

ZINC09007801

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 4th, 2007 31 No

Popular Name: 5-(4-chlorophenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(4-propoxyphenyl)-methylene]-pyrrolidine-2,3- 5-(4-chlorophenyl)-1-(2-dimethyl…

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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) 4.02 10.98 -70.57 1 6 0 74 442.943 9 ↓
Hi High (pH 8-9.5) 4.02 8.45 -55.84 0 6 -1 73 441.935 9 ↓
Mid Mid (pH 6-8) 4.47 11.7 -47.18 2 6 1 71 443.951 8 ↓

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