| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 12th, 2011 | 18 | No |
Popular Name: 6-methyl-2-[(2S)-2-methylazepan-1-yl]pyridine-3-carbothioamide 6-methyl-2-[(2S)-2-methylazepan-…
| 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) | 2.69 | 6.84 | -9.89 | 2 | 3 | 0 | 42 | 263.41 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.69 | 7.29 | -34.97 | 3 | 3 | 1 | 43 | 264.418 | 2 | ↓ |
