In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 3rd, 2010 | 19 | No |
Popular Name: 2-[(1-ethyl-4-piperidyl)-methyl-amino]pyridine-3-carbothioamide 2-[(1-ethyl-4-piperidyl)-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) | 1.69 | 7.15 | -37.3 | 3 | 4 | 1 | 47 | 279.433 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.69 | 7.6 | -86.8 | 4 | 4 | 2 | 48 | 280.441 | 4 | ↓ |