| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 19 | No |
Popular Name: 6-methyl-2-[[(1S)-1-(3-pyridyl)ethyl]amino]pyridine-3-carbothioamide 6-methyl-2-[[(1S)-1-(3-pyridyl)e…
| 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) | 1.42 | 5.43 | -13.9 | 3 | 4 | 0 | 64 | 272.377 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.42 | 5.73 | -43.83 | 4 | 4 | 1 | 65 | 273.385 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.42 | 6.21 | -92.05 | 5 | 4 | 2 | 66 | 274.393 | 4 | ↓ |
