| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 17 | Yes |
Popular Name: [4-(2-aminoethyl)-1,4-diazepan-1-yl]-(2-furyl)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) | -0.40 | 2.13 | -52.45 | 3 | 5 | 1 | 64 | 238.311 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.40 | 3.92 | -129.41 | 4 | 5 | 2 | 66 | 239.319 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.40 | 3.53 | -42.49 | 3 | 5 | 1 | 64 | 238.311 | 3 | ↓ |
