In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2008 | 24 | Yes |
Popular Name: 1-[(3-chlorophenyl)methyl]-4-(3-fluorophenyl)sulfonyl-piperazine 1-[(3-chlorophenyl)methyl]-4-(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) | 3.34 | 6.27 | -9.37 | 0 | 4 | 0 | 41 | 368.861 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.34 | 8.49 | -50.12 | 1 | 4 | 1 | 42 | 369.869 | 4 | ↓ |