| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 1st, 2008 | 30 | Yes |
Popular Name: N,N-dimethyl-3-[(p-tolylmethyl-(4-pyridylmethyl)amino)methyl]quinolin-2-amine N,N-dimethyl-3-[(p-tolylmethyl-(…
| 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) | 4.08 | 14.19 | -46.17 | 1 | 4 | 1 | 33 | 397.546 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.08 | 11.46 | -8.36 | 0 | 4 | 0 | 32 | 396.538 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.08 | 12.64 | -27.09 | 1 | 4 | 1 | 34 | 397.546 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.08 | 14.69 | -183.83 | 3 | 4 | 3 | 36 | 399.562 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.08 | 14.99 | -103.34 | 2 | 4 | 2 | 35 | 398.554 | 7 | ↓ |
