UCSF

ZINC20888419

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 29th, 2008 34 No

Popular Name: 2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[4-(3-nitrophenyl)thiazol-2-yl]acetamide 2-(3-butyl-4-oxo-quinazolin-2-yl…

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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) 4.87 13.08 -21.75 1 9 0 123 495.586 9 ↓
Hi High (pH 8-9.5) 5.06 12.02 -45.74 0 9 -1 129 494.578 9 ↓

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

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