In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2006 | 22 | Yes |
Popular Name: 1-(1-piperidyl)-4-(2-thia-5-azabicyclo[4.4.0]deca-7,9,11-trien-5-yl)butane-1,4-dione 1-(1-piperidyl)-4-(2-thia-5-azab…
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) | 1.74 | -0.83 | -9.79 | 0 | 4 | 0 | 40 | 318.442 | 3 | ↓ |