| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2011 | 21 | Yes |
Popular Name: 4-[[ethyl(isopropyl)amino]methyl]-N-(4H-1,2,4-triazol-3-yl)benzamide 4-[[ethyl(isopropyl)amino]methyl…
| 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) | 1.46 | 9.21 | -73.93 | 2 | 6 | 0 | 73 | 287.367 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.52 | 7.82 | -63.85 | 2 | 6 | 0 | 81 | 287.367 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.46 | 9.28 | -48.19 | 3 | 6 | 1 | 75 | 288.375 | 6 | ↓ |
