In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2011 | 18 | Yes |
Popular Name: 1-[2-fluoro-5-(trifluoromethyl)phenyl]piperidin-2-imine 1-[2-fluoro-5-(trifluoromethyl)p…
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) | 3.61 | 7.68 | -29.89 | 2 | 2 | 1 | 29 | 261.242 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.61 | 7.72 | -4.94 | 1 | 2 | 0 | 27 | 260.234 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.