In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 24 | Yes |
Popular Name: 3-(butanoylamino)-N-[(1-ethylimidazol-2-yl)methyl]-N-methyl-benzamide 3-(butanoylamino)-N-[(1-ethylimi…
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) | 1.43 | 8.88 | -41.32 | 2 | 6 | 1 | 68 | 329.424 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.43 | 8.03 | -23.3 | 1 | 6 | 0 | 67 | 328.416 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.