UCSF

ZINC14571155

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 12th, 2008 27 Yes

Popular Name: N-[(7-chloro-4-oxo-3H-quinazolin-2-yl)methyl]-2,3-dimethyl-N-propyl-benzamide N-[(7-chloro-4-oxo-3H-quinazolin…

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Download: MOL2 SDF SMILES Flexibase

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) 3.79 10.68 -12.52 1 5 0 66 383.879 5 ↓
Hi High (pH 8-9.5) 4.25 7.98 -46.37 0 5 -1 69 382.871 5 ↓

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

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