In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2010 | 16 | Yes |
Popular Name: (2R)-1-(3-chloro-4-fluoro-phenyl)-2-ethyl-piperazine (2R)-1-(3-chloro-4-fluoro-phenyl…
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) | 2.97 | 6.33 | -45.61 | 2 | 2 | 1 | 20 | 243.733 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.97 | 5.02 | -2.6 | 1 | 2 | 0 | 15 | 242.725 | 2 | ↓ |