| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 21 | Yes |
Popular Name: 2-[4-[(3-chloro-5-cyano-2-pyridyl)amino]-1-piperidyl]-N-methyl-acetamide 2-[4-[(3-chloro-5-cyano-2-pyridy…
| 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) | 1.29 | 5.37 | -45.48 | 3 | 6 | 1 | 82 | 308.793 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.29 | 3.2 | -10.7 | 2 | 6 | 0 | 81 | 307.785 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
