UCSF

ZINC55510148

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 15th, 2010 28 No

Popular Name: (6E)-6-(1,3-benzodioxol-5-ylmethylene)-5-imino-2-(m-tolyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one (6E)-6-(1,3-benzodioxol-5-ylmeth…

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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) 2.56 6.89 -14.66 1 7 0 90 390.424 2 ↓
Lo Low (pH 4.5-6) 2.56 6.85 -33.46 2 7 1 91 391.432 2 ↓

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

No pre-computed analogs available. Try a structural similarity search.