UCSF

ZINC03590555

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2004 28 Yes

Popular Name: 4-allyl-1-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-[1,2,4]triazolo[4,3-a]quinazolin-5-one 4-allyl-1-[[2-(4-chlorophenyl)-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) 4.27 14.22 -12.09 0 6 0 69 410.886 6 ↓

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Rings

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

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