| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 20th, 2011 | 25 | Yes |
Popular Name: 2-[4-[(3-cyano-5,7-difluoro-4-quinolyl)amino]-1-piperidyl]acetamide 2-[4-[(3-cyano-5,7-difluoro-4-qu…
| 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) | 1.82 | 4.89 | -42.26 | 4 | 6 | 1 | 96 | 346.361 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.82 | 2.69 | -10.09 | 3 | 6 | 0 | 95 | 345.353 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
