UCSF

ZINC62947237

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 19th, 2011 18 Yes

Popular Name: 5-(5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)pyridin-3-amine 5-(5,7-dimethyl-[1,2,4]triazolo[…

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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) 1.18 5.94 -19.62 2 6 0 82 240.27 1 ↓
Lo Low (pH 4.5-6) 1.18 6.4 -48.76 3 6 1 83 241.278 1 ↓

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

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