| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 19 | Yes |
Popular Name: 2-[4-(2-aminoethyl)-1,4-diazepan-1-yl]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) | -1.12 | 0.8 | -48.5 | 5 | 6 | 1 | 90 | 264.353 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -1.12 | 2.59 | -115.51 | 6 | 6 | 2 | 91 | 265.361 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -1.12 | 1.31 | -92 | 6 | 6 | 2 | 91 | 265.361 | 4 | ↓ |
