| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 20 | No |
Popular Name: 6-methyl-2-[methyl-[2-(4-pyridyl)ethyl]amino]pyridine-3-carbothioamide 6-methyl-2-[methyl-[2-(4-pyridyl…
| 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) | 1.46 | 7.25 | -13.46 | 2 | 4 | 0 | 55 | 286.404 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.46 | 7.66 | -42.4 | 3 | 4 | 1 | 56 | 287.412 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.46 | 7.71 | -36.64 | 3 | 4 | 1 | 56 | 287.412 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.46 | 8.12 | -81.98 | 4 | 4 | 2 | 58 | 288.42 | 5 | ↓ |
