| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 20 | No |
Popular Name: 6-[[(1S)-4-diethylamino-1-methyl-butyl]amino]pyridine-3-carbothioamide 6-[[(1S)-4-diethylamino-1-methyl…
| 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) | 2.35 | 7.56 | -50.36 | 4 | 4 | 1 | 55 | 295.476 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.35 | 8.01 | -112.09 | 5 | 4 | 2 | 57 | 296.484 | 9 | ↓ |
