| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 22nd, 2009 | 21 | Yes |
Popular Name: 1,4-diazepan-1-yl-[5-(3-dimethylaminoprop-1-ynyl)-3-pyridyl]methanone 1,4-diazepan-1-yl-[5-(3-dimethyl…
| 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) | -0.56 | 4.31 | -54.98 | 2 | 5 | 1 | 53 | 287.387 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.56 | 6.88 | -97.17 | 3 | 5 | 2 | 54 | 288.395 | 2 | ↓ |
