| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 20th, 2012 | 23 | Yes |
Popular Name: 6-chloro-4-hydroxy-N-[2-(2-pyridyl)ethyl]quinoline-3-carboxamide 6-chloro-4-hydroxy-N-[2-(2-pyrid…
| 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) | 1.12 | 6.24 | -17.47 | 2 | 5 | 0 | 75 | 327.771 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.42 | 6.08 | -54.66 | 1 | 5 | -1 | 78 | 326.763 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.12 | 6.59 | -38.49 | 3 | 5 | 1 | 76 | 328.779 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.