UCSF

ZINC57731322

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 24th, 2011 25 Yes

Popular Name: 2-[2-(azepan-1-yl)-2-oxo-ethyl]-8-chloro-[1,2,4]triazolo[4,3-c]quinazolin-3-one 2-[2-(azepan-1-yl)-2-oxo-ethyl]-…

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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) 2.30 10.68 -14.35 0 7 0 73 359.817 2 ↓

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

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