In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2009 | 17 | Yes |
Popular Name: 2-(1,4-diazepan-1-yl)-4,6-dimethyl-pyridine-3-carbonitrile 2-(1,4-diazepan-1-yl)-4,6-dimeth…
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) | 1.23 | 6.67 | -40.29 | 2 | 4 | 1 | 57 | 231.323 | 1 | ↓ |