| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 20 | Yes |
Popular Name: 2-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-6-methyl-pyridine-3-carboxamidine 2-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-o…
| 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) | 1.71 | 6.42 | -35.26 | 4 | 4 | 1 | 68 | 273.404 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.71 | 7.52 | -7.32 | 3 | 4 | 0 | 66 | 272.396 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.71 | 6.83 | -90.52 | 5 | 4 | 2 | 69 | 274.412 | 2 | ↓ |
