UCSF

ZINC09046337

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2007 34 No

Popular Name: 1-(6-fluorobenzothiazol-2-yl)-4-[(4-fluorophenyl)-hydroxy-methylene]-5-(3-methoxyphenyl)-pyrrolidine 1-(6-fluorobenzothiazol-2-yl)-4-…

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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) 4.97 11.07 -54.52 0 6 -1 83 477.468 5 ↓
Mid Mid (pH 6-8) 4.39 11.35 -13.31 0 6 0 77 478.476 5 ↓
Mid Mid (pH 6-8) 4.97 10.95 -14.32 1 6 0 80 478.476 5 ↓

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