UCSF

ZINC24567127

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 18th, 2009 31 No

Popular Name: (E)-2-(4-aminoquinazolin-2-yl)-3-(4-benzyloxy-3-methoxy-phenyl)prop-2-enenitrile (E)-2-(4-aminoquinazolin-2-yl)-3…

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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) 4.34 11.34 -20.46 2 6 0 94 408.461 6 ↓

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

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