UCSF

ZINC69209682

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 20th, 2011 30 Yes

Popular Name: 3-chloro-4-ethoxy-N-isopropyl-5-methoxy-N-[(4-oxo-3H-quinazolin-2-yl)methyl]benzamide 3-chloro-4-ethoxy-N-isopropyl-5-…

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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) 2.95 9.04 -14.44 1 7 0 85 429.904 7 ↓
Hi High (pH 8-9.5) 3.41 7.03 -55.88 0 7 -1 88 428.896 7 ↓

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

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