UCSF

ZINC13408894

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 18th, 2008 34 Yes

Popular Name: (3R)-1-[2-[(4-benzyl-5-oxo-[1,2,4]triazolo[4,5-a]quinazolin-1-yl)sulfanyl]acetyl]piperidine-3-carbox (3R)-1-[2-[(4-benzyl-5-oxo-[1,2,…

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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) 2.77 14.54 -57.64 0 9 -1 113 476.538 6 ↓

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

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