UCSF

ZINC49389559

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 28th, 2010 20 Yes

Popular Name: 2-[[methyl-[(2-methylthiazol-4-yl)methyl]amino]methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one 2-[[methyl-[(2-methylthiazol-4-y…

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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) 0.78 8.47 -35.46 1 6 1 57 290.372 4 ↓
Mid Mid (pH 6-8) 0.78 5.92 -13.65 0 6 0 55 289.364 4 ↓

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

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