| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2010 | 24 | No |
Popular Name: 1-(2-cyanoethyl)-N-(2-methoxy-5-nitro-phenyl)piperidine-4-carboxamide 1-(2-cyanoethyl)-N-(2-methoxy-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) | 1.32 | 7.86 | -63.99 | 2 | 8 | 1 | 112 | 333.368 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.32 | 5.61 | -17.87 | 1 | 8 | 0 | 111 | 332.36 | 6 | ↓ |
