| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 20 | Yes |
Popular Name: [4-(2-aminoethyl)-1,4-diazepan-1-yl]-(3-methoxyphenyl)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) | -0.10 | 2.97 | -49.96 | 3 | 5 | 1 | 60 | 278.376 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.10 | 4.76 | -122.83 | 4 | 5 | 2 | 62 | 279.384 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.10 | 4.37 | -38.99 | 3 | 5 | 1 | 60 | 278.376 | 4 | ↓ |
