In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 7th, 2010 | 17 | No |
Popular Name: N-(1,3-benzothiazol-2-yl)-2-(cyanomethylsulfanyl)acetamide N-(1,3-benzothiazol-2-yl)-2-(cya…
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) | 1.98 | 6.03 | -20.98 | 1 | 4 | 0 | 66 | 263.347 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.17 | 4.62 | -46.78 | 0 | 4 | -1 | 72 | 262.339 | 4 | ↓ |