| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 21 | Yes |
Popular Name: 8-methyl-N-(1-prop-2-ynyl-4-piperidyl)quinolin-5-amine 8-methyl-N-(1-prop-2-ynyl-4-pipe…
| 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) | 3.70 | 9.04 | -45.26 | 2 | 3 | 1 | 29 | 280.395 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.70 | 6.76 | -7.62 | 1 | 3 | 0 | 28 | 279.387 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.70 | 7.11 | -30.21 | 2 | 3 | 1 | 29 | 280.395 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.70 | 9.39 | -79.64 | 3 | 3 | 2 | 31 | 281.403 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
