UCSF

ZINC08856413

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 30th, 2007 32 No

Popular Name: 1-(3-dimethylaminopropyl)-5-(2-fluorophenyl)-4-[hydroxy-(4-isopropoxyphenyl)-methylene]-pyrrolidine- 1-(3-dimethylaminopropyl)-5-(2-f…

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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) 3.59 11.74 -73.18 1 6 0 74 440.515 9 ↓
Mid Mid (pH 6-8) 4.04 11.58 -47.35 2 6 1 71 441.523 8 ↓
Mid Mid (pH 6-8) 3.01 12.11 -46.46 1 6 1 68 441.523 9 ↓

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