In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 21 | No |
Popular Name: 1-[2-(chloromethyl)-4-fluoro-phenyl]-4-(2-pyridyl)piperazine 1-[2-(chloromethyl)-4-fluoro-phe…
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) | 3.40 | 10.58 | -31.49 | 1 | 3 | 1 | 21 | 306.792 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.40 | 10.26 | -5.86 | 0 | 3 | 0 | 19 | 305.784 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.