UCSF

ZINC21540495

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2008 34 Yes

Popular Name: 7-(3,5-dimethylphenyl)-3-[3-oxo-3-[4-(2-pyridyl)piperazin-1-yl]propyl]-[1,2,4]triazolo[3,4-c]pyrazin 7-(3,5-dimethylphenyl)-3-[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) 2.50 12.78 -56.31 1 9 1 90 458.546 5 ↓
Mid Mid (pH 6-8) 2.50 12.52 -22.56 0 9 0 89 457.538 5 ↓

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

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