| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 17 | Yes |
Popular Name: 2-(4-methyl-1,4-diazepan-1-yl)pyridine-4-carboxamidine 2-(4-methyl-1,4-diazepan-1-yl)py…
| 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) | -0.36 | 3.9 | -87.37 | 5 | 5 | 2 | 72 | 235.335 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.36 | 1.66 | -40.28 | 4 | 5 | 1 | 71 | 234.327 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.36 | 4.08 | -170.89 | 6 | 5 | 3 | 73 | 236.343 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.36 | 3.58 | -92.33 | 5 | 5 | 2 | 72 | 235.335 | 2 | ↓ |
