| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2010 | 20 | Yes |
Popular Name: (3R)-3-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]butanenitrile (3R)-3-[4-(1,3-benzothiazol-2-yl…
| 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) | 2.29 | 9.19 | -48.71 | 1 | 3 | 1 | 41 | 286.424 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.29 | 7.25 | -14.28 | 0 | 3 | 0 | 40 | 285.416 | 3 | ↓ |
