UCSF

ZINC65154539

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 5th, 2011 23 Yes

Popular Name: 3-[(5-ethyl-7,8-dimethyl-3-oxo-[1,2,4]triazolo[3,4-f]pyrimidin-2-yl)methyl]benzonitrile 3-[(5-ethyl-7,8-dimethyl-3-oxo-[…

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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) 2.16 10.72 -9.77 0 6 0 76 307.357 3 ↓

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

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