| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 19 | Yes |
Popular Name: [4-(2-aminoethyl)-1,4-diazepan-1-yl]-(4-hydroxyphenyl)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) | -0.61 | 0.83 | -51.84 | 4 | 5 | 1 | 71 | 264.349 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.61 | 2.63 | -125.95 | 5 | 5 | 2 | 73 | 265.357 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.61 | 2.24 | -41.89 | 4 | 5 | 1 | 71 | 264.349 | 3 | ↓ |
