UCSF

ZINC08739567

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2007 32 No

Popular Name: 5-(4-fluorophenyl)-4-[hydroxy-(4-isopropoxyphenyl)-methylene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-pyr 5-(4-fluorophenyl)-4-[hydroxy-(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) 3.47 10.02 -51.87 0 7 -1 95 452.487 6 ↓
Mid Mid (pH 6-8) 2.88 1.15 -11.96 0 7 0 89 453.495 6 ↓
Lo Low (pH 4.5-6) 3.47 9.21 -15.39 1 7 0 93 453.495 6 ↓

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