In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 17th, 2008 | 28 | Yes |
Popular Name: 1-[(2-chloro-6-fluoro-phenyl)methyl]-4-[2-(trifluoromethyl)phenyl]sulfonyl-piperazine 1-[(2-chloro-6-fluoro-phenyl)met…
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) | 4.13 | 7.41 | -14.93 | 0 | 4 | 0 | 41 | 436.858 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.13 | 9.64 | -48.88 | 1 | 4 | 1 | 42 | 437.866 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.