UCSF

ZINC49407287

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 28th, 2010 29 Yes

Popular Name: N-(2-chloro-4-methyl-phenyl)-2-[5-methyl-3-oxo-7-(2-pyridyl)-[1,2,4]triazolo[3,4-f]pyrimidin-2-yl]ac N-(2-chloro-4-methyl-phenyl)-2-[…

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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) 2.05 10.07 -15.4 1 8 0 94 408.849 4 ↓

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

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