In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2007 | 23 | Yes |
Popular Name: N-(3H-benzothiazol-2-ylidene)-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide N-(3H-benzothiazol-2-ylidene)-2-…
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) | 3.46 | 7.84 | -17.39 | 1 | 4 | 0 | 45 | 323.421 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.02 | 8.78 | -35.61 | 2 | 4 | 1 | 50 | 324.429 | 2 | ↓ |