In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 16 | No |
Popular Name: 2-[(3S)-3-hydroxy-1-piperidyl]pyridine-3-carbothioamide 2-[(3S)-3-hydroxy-1-piperidyl]py…
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) | 0.65 | 2.18 | -13.62 | 3 | 4 | 0 | 62 | 237.328 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.65 | 2.64 | -43.8 | 4 | 4 | 1 | 64 | 238.336 | 2 | ↓ |