UCSF

ZINC62285929

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 28th, 2011 28 Yes

Popular Name: N-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]-4-([1,2,4]triazolo[4,3-a]pyrimidin-3-yl)benzamide N-[2-(4-methylpiperazin-1-yl)-2-…

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Vendors

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) 0.39 9.4 -63.51 2 9 1 97 380.432 4 ↓
Mid Mid (pH 6-8) 0.39 7.05 -23.9 1 9 0 96 379.424 4 ↓

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

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