UCSF

ZINC13127809

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 29th, 2008 24 No

Popular Name: 3-[[(E)-(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]amino]-2-propyl-quinazolin-4-one 3-[[(E)-(2-hydroxy-4-oxo-1-cyclo…

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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) 2.62 7.92 -61.31 1 6 -1 87 322.344 4 ↓
Mid Mid (pH 6-8) 1.08 7.93 -19.43 1 6 0 81 323.352 4 ↓

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

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