| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 21 | Yes |
Popular Name: 2-[4-[(2S)-3-amino-2-methyl-propyl]-1,4-diazepan-1-yl]pyridine-3-carboxamide 2-[4-[(2S)-3-amino-2-methyl-prop…
| 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) | -0.38 | 4.06 | -108.19 | 6 | 6 | 2 | 91 | 293.415 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.38 | 2.54 | -46.47 | 5 | 6 | 1 | 90 | 292.407 | 5 | ↓ |
