| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 19 | Yes |
Popular Name: [4-(2-aminoethyl)-1,4-diazepan-1-yl]-(m-tolyl)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) | 0.30 | 4.34 | -50.12 | 3 | 4 | 1 | 51 | 262.377 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.30 | 6.13 | -123.23 | 4 | 4 | 2 | 52 | 263.385 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.30 | 5.73 | -39.44 | 3 | 4 | 1 | 51 | 262.377 | 3 | ↓ |
