| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 20 | Yes |
Popular Name: 1-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-3-cyclohexyl-propan-1-one 1-[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) | 1.64 | 5.74 | -49.39 | 3 | 4 | 1 | 51 | 282.452 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.64 | 7.54 | -124.07 | 4 | 4 | 2 | 52 | 283.46 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.64 | 7.14 | -39.47 | 3 | 4 | 1 | 51 | 282.452 | 5 | ↓ |
