In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 15 | Yes |
Popular Name: 3-(azepan-1-yl)benzonitrile 3-(azepan-1-yl)benzonitrile
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) | 3.18 | 6.55 | -4.53 | 0 | 2 | 0 | 27 | 200.285 | 1 | ↓ |