UCSF

ZINC08817909

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 29th, 2007 31 No

Popular Name: 4-[(4-fluorophenyl)-hydroxy-methylene]-5-(4-tert-butylphenyl)-1-(1,3,4-thiadiazol-2-yl)pyrrolidine-2 4-[(4-fluorophenyl)-hydroxy-meth…

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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) 4.66 10.73 -51.08 0 6 -1 86 436.488 5 ↓
Mid Mid (pH 6-8) 5.11 10.63 -18.45 1 6 0 83 437.496 4 ↓
Mid Mid (pH 6-8) 4.08 10.93 -10.89 0 6 0 80 437.496 5 ↓

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