In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 18 | No |
Popular Name: 2-[(3S)-3-ethyl-1-piperidyl]-6-methyl-pyridine-3-carbothioamide 2-[(3S)-3-ethyl-1-piperidyl]-6-m…
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) | 2.60 | 7.37 | -11.23 | 2 | 3 | 0 | 42 | 263.41 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.60 | 7.79 | -36.09 | 3 | 3 | 1 | 43 | 264.418 | 3 | ↓ |