| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 26th, 2011 | 19 | Yes |
Popular Name: 1-[(7-chloro-1,3-benzodioxol-5-yl)methyl]piperidine-4-carbonitrile 1-[(7-chloro-1,3-benzodioxol-5-y…
| 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) | 2.80 | 7.73 | -59.02 | 1 | 4 | 1 | 47 | 279.747 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.80 | 5.47 | -10.53 | 0 | 4 | 0 | 45 | 278.739 | 2 | ↓ |
