In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 18 | Yes |
Popular Name: (1R)-2-(2,5-difluorophenyl)-N-methyl-1-(3-pyridyl)ethanamine (1R)-2-(2,5-difluorophenyl)-N-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) | 2.50 | 7.06 | -41.23 | 2 | 2 | 1 | 29 | 249.284 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.50 | 5.92 | -5.36 | 1 | 2 | 0 | 25 | 248.276 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.50 | 7.55 | -103.7 | 3 | 2 | 2 | 31 | 250.292 | 4 | ↓ |