In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2008 | 29 | Yes |
Popular Name: [2-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-oxo-ethyl] [2-[(3-cyano-4,5,6,7-tetrahydrob…
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) | 3.97 | 9.55 | -11.76 | 1 | 7 | 0 | 98 | 414.483 | 7 | ↓ |