| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2009 | 21 | Yes |
Popular Name: N-methyl-1-[2-(4-methyl-1,4-diazepan-1-yl)-3-quinolyl]methanamine N-methyl-1-[2-(4-methyl-1,4-diaz…
| 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) | 2.04 | 9.36 | -96.39 | 3 | 4 | 2 | 37 | 286.423 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.04 | 8.22 | -32.38 | 2 | 4 | 1 | 33 | 285.415 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.04 | 9.87 | -179.36 | 4 | 4 | 3 | 38 | 287.431 | 3 | ↓ |
