In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 31 | No |
Popular Name: 1-cyclohexyl-4-[4-(4-phenoxyphenyl)tetrahydrothiopyran-4-yl]piperazine 1-cyclohexyl-4-[4-(4-phenoxyphen…
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) | 6.47 | 14.92 | -42.6 | 1 | 3 | 1 | 17 | 437.673 | 5 | ↓ |
Hi High (pH 8-9.5) | 6.47 | 12.49 | -3.85 | 0 | 3 | 0 | 16 | 436.665 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.