In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 17 | No |
Popular Name: 2-[(2R,6S)-2,6-dimethyl-1-piperidyl]pyridine-3-carbothioamide 2-[(2R,6S)-2,6-dimethyl-1-piperi…
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) | 2.46 | 6.3 | -12.74 | 2 | 3 | 0 | 42 | 249.383 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.46 | 6.72 | -43.67 | 3 | 3 | 1 | 43 | 250.391 | 2 | ↓ |