| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 14th, 2010 | 20 | Yes |
Popular Name: 2-(4-methyl-1,4-diazepan-1-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile 2-(4-methyl-1,4-diazepan-1-yl)-5…
| 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) | 2.40 | 10.19 | -35.24 | 1 | 4 | 1 | 44 | 271.388 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.40 | 8.17 | -5.42 | 0 | 4 | 0 | 43 | 270.38 | 1 | ↓ |
