In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 20 | No |
Popular Name: 6-methyl-2-[[(1S)-1-methyl-2-(1-piperidyl)ethyl]amino]pyridine-3-carbothioamide 6-methyl-2-[[(1S)-1-methyl-2-(1-…
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) | 1.97 | 7.65 | -42.9 | 4 | 4 | 1 | 55 | 293.46 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.97 | 7.95 | -102.14 | 5 | 4 | 2 | 57 | 294.468 | 5 | ↓ |