UCSF

ZINC59816378

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 11th, 2011 25 Yes

Popular Name: 7-methyl-5-oxo-6-phenyl-2-(3-pyridyl)-3H-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile 7-methyl-5-oxo-6-phenyl-2-(3-pyr…

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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) 3.06 8.94 -40.2 0 6 -1 85 326.339 2 ↓
Lo Low (pH 4.5-6) 3.06 9.39 -46.99 1 6 0 86 327.347 2 ↓

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

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