| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 31st, 2006 | 36 | No |
Popular Name: 1-(6-methyl-2-quinolyl)-3-[6-[(6-methyl-2-quinolyl)thiocarbamoylamino]hexyl]thiourea 1-(6-methyl-2-quinolyl)-3-[6-[(6…
| 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) | 6.75 | 17.25 | -31.92 | 4 | 6 | 0 | 74 | 516.74 | 13 | ↓ |
| Lo Low (pH 4.5-6) | 6.75 | 16.96 | -68.11 | 6 | 6 | 2 | 76 | 518.756 | 13 | ↓ |
| Lo Low (pH 4.5-6) | 6.75 | 17.11 | -45.27 | 5 | 6 | 1 | 75 | 517.748 | 13 | ↓ |
