| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 17 | Yes |
Popular Name: [4-(2-aminoethyl)-1,4-diazepan-1-yl]-cyclopentyl-methanone [4-(2-aminoethyl)-1,4-diazepan-1…
| 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) | 0.41 | 3.46 | -49.51 | 3 | 4 | 1 | 51 | 240.371 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.41 | 5.26 | -123.85 | 4 | 4 | 2 | 52 | 241.379 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.41 | 4.87 | -39.42 | 3 | 4 | 1 | 51 | 240.371 | 3 | ↓ |
