| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 2nd, 2009 | 23 | Yes |
Popular Name: (2S)-2-[[4-(1,3-benzothiazol-2-yl)-1-piperidyl]methyl]pentanedinitrile (2S)-2-[[4-(1,3-benzothiazol-2-y…
| 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) | 2.39 | 10.78 | -66.09 | 1 | 4 | 1 | 65 | 325.461 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.39 | 8.73 | -19.31 | 0 | 4 | 0 | 64 | 324.453 | 5 | ↓ |
