In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2010 | 19 | No |
Popular Name: 2-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]acetonitrile 2-[4-[(3-fluoro-4-methoxy-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) | 1.57 | 3.32 | -10.63 | 0 | 4 | 0 | 40 | 263.316 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.57 | 5.58 | -51.2 | 1 | 4 | 1 | 41 | 264.324 | 4 | ↓ |