UCSF

ZINC33827838

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 24 Yes

Popular Name: 2-(1,3-Benzodioxol-5-yl)-5-methyl-6-phenylimidazo(2,1-b)-1,3,4-thiadiazole; Imidazo(2,1-b)-1,3,4-thiadiazole, 2-(1,3-benzodioxol-5-yl)-5-methyl-6-phenyl-; LS-80566 2-(1,3-Benzodioxol-5-yl)-5-methy…

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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) 4.40 9.02 -11.28 0 5 0 49 335.388 2 ↓
Lo Low (pH 4.5-6) 4.40 9.4 -25.63 1 5 1 50 336.396 2 ↓

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