| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 17 | Yes |
Popular Name: 5-[4-[(1S)-1-methylpropyl]-1,4-diazepan-1-yl]pentan-1-amine 5-[4-[(1S)-1-methylpropyl]-1,4-d…
| 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) | 1.56 | 5.55 | -79.38 | 4 | 3 | 2 | 35 | 243.439 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.56 | 3.96 | -40.46 | 3 | 3 | 1 | 34 | 242.431 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.56 | 7.38 | -171.72 | 5 | 3 | 3 | 37 | 244.447 | 7 | ↓ |
