| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 29th, 2009 | 21 | Yes |
Popular Name: 2-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-4,6-dimethyl-pyridine-3-carboxamide 2-[4-(2-aminoethyl)-1,4-diazepan…
| 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) | -0.31 | 1.78 | -89.09 | 6 | 6 | 2 | 91 | 293.415 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.31 | 1.32 | -50.01 | 5 | 6 | 1 | 90 | 292.407 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.31 | 3.61 | -196.39 | 7 | 6 | 3 | 93 | 294.423 | 4 | ↓ |
