UCSF

ZINC55073737

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2010 26 Yes

Popular Name: 4-allyloxy-3-ethoxy-N-[(1S)-1-methyl-2-(3-methyl-2-pyridyl)ethyl]benzamide 4-allyloxy-3-ethoxy-N-[(1S)-1-me…

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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) 3.55 8.49 -13.05 1 5 0 60 354.45 9 ↓
Lo Low (pH 4.5-6) 3.55 8.97 -45.76 2 5 1 62 355.458 9 ↓

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

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