UCSF

ZINC09007663

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 4th, 2007 33 No

Popular Name: 5-(3,4-dimethoxyphenyl)-4-[(4-fluorophenyl)-hydroxy-methylene]-1-(3-pyridylmethyl)pyrrolidine-2,3-di 5-(3,4-dimethoxyphenyl)-4-[(4-fl…

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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) 2.35 9.13 -55 0 7 -1 92 447.442 7 ↓
Mid Mid (pH 6-8) 1.77 1 -16.07 0 7 0 85 448.45 7 ↓
Lo Low (pH 4.5-6) 2.80 1.26 -49.16 2 7 1 90 449.458 6 ↓
Lo Low (pH 4.5-6) 1.77 1.11 -46.75 1 7 1 87 449.458 7 ↓
Lo Low (pH 4.5-6) 2.35 8.3 -16.43 1 7 0 89 448.45 7 ↓

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