In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 28 | Yes |
Popular Name: N-[6-[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]-3-pyridyl]-3-methyl-but-2-enamide N-[6-[4-[(2,4-difluorophenyl)met…
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) | 3.71 | 8.7 | -9.89 | 1 | 5 | 0 | 48 | 386.446 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.71 | 9.05 | -35.1 | 2 | 5 | 1 | 50 | 387.454 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.71 | 10.91 | -45.16 | 2 | 5 | 1 | 50 | 387.454 | 5 | ↓ |