In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 2010 | 17 | No |
Popular Name: 6-[(2R)-2-(hydroxymethyl)-1-piperidyl]pyridine-3-carbothioamide 6-[(2R)-2-(hydroxymethyl)-1-pipe…
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) | 1.21 | 2.4 | -12.74 | 3 | 4 | 0 | 62 | 251.355 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.21 | 2.88 | -40.47 | 4 | 4 | 1 | 64 | 252.363 | 3 | ↓ |