UCSF

ZINC18957027

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 20th, 2008 31 Yes

Popular Name: 2-[[5-oxo-4-(p-tolyl)-[1,2,4]triazolo[4,5-a]quinazolin-1-yl]sulfanylmethyl]benzonitrile 2-[[5-oxo-4-(p-tolyl)-[1,2,4]tri…

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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) 4.83 16.9 -19.86 0 6 0 76 423.501 4 ↓

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Rings

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

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