In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2011 | 15 | Yes |
Popular Name: 2-(4,5-dihydrothieno[3,2-e][1,3]benzothiazol-2-yl)acetonitrile 2-(4,5-dihydrothieno[3,2-e][1,3]…
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) | 2.52 | 6.68 | -12.48 | 0 | 2 | 0 | 37 | 232.333 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.