In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 25 | Yes |
Popular Name: 2-cyclohexyl-4-piperazin-1-yl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine 2-cyclohexyl-4-piperazin-1-yl-5,…
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) | 3.99 | 10.85 | -48.96 | 2 | 4 | 1 | 46 | 357.547 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.99 | 9.52 | -6.21 | 1 | 4 | 0 | 41 | 356.539 | 2 | ↓ |