| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 28 | Yes |
Popular Name: (2S)-2-(1,3-benzothiazol-2-yl)-4-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-3-oxo-butanenitrile (2S)-2-(1,3-benzothiazol-2-yl)-4…
| 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) | 0.78 | 9.63 | -24.91 | 0 | 9 | 0 | 116 | 394.416 | 4 | ↓ |
