UCSF

ZINC20616177

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 26th, 2008 39 No

Popular Name: 2-acetamido-N-[[4-ethoxy-3-[(oxoBLAHyl)methyl]phenyl]methyleneamino]benzamide 2-acetamido-N-[[4-ethoxy-3-[(oxo…

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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) 2.96 12.49 -63.83 3 9 1 106 528.633 8 ↓
Mid Mid (pH 6-8) 2.96 10.21 -28.3 2 9 0 105 527.625 8 ↓

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

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