UCSF

ZINC38737640

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2010 26 Yes

Popular Name: N-benzyl-N-(2-cyanoethyl)-3-propyl-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide N-benzyl-N-(2-cyanoethyl)-3-prop…

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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) 1.70 12.61 -22.45 0 6 0 74 347.422 7 ↓

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

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