| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 21 | Yes |
Popular Name: [(2S,6R)-2,6-dimethylpiperazin-1-yl]-(2-hydroxy-4-quinolyl)methanone [(2S,6R)-2,6-dimethylpiperazin-1…
| 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) | 0.31 | 3.66 | -53.9 | 3 | 5 | 1 | 70 | 286.355 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.31 | 2.34 | -10.4 | 2 | 5 | 0 | 65 | 285.347 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
