| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 21 | Yes |
Popular Name: 6-bromo-N4-[2-(1-piperidyl)ethyl]quinoline-3,4-diamine 6-bromo-N4-[2-(1-piperidyl)ethyl…
| 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) | 3.38 | 7.04 | -84.66 | 5 | 4 | 2 | 57 | 351.292 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.38 | 4.38 | -4.64 | 3 | 4 | 0 | 54 | 349.276 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.38 | 6.61 | -37.73 | 4 | 4 | 1 | 55 | 350.284 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
