In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 29th, 2008 | 27 | Yes |
Popular Name: [4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-1-yl]BLAH [4-[(2-chloro-6-fluoro-phenyl)me…
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) | 2.98 | 12.06 | -14.05 | 0 | 6 | 0 | 50 | 386.862 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.98 | 14.26 | -45.09 | 1 | 6 | 1 | 51 | 387.87 | 3 | ↓ |