In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 19 | Yes |
Popular Name: (2R)-1-(3-bromo-4-fluoro-phenyl)-N-methyl-3-(4-pyridyl)propan-2-amine (2R)-1-(3-bromo-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) | 3.31 | 8.21 | -53.75 | 2 | 2 | 1 | 29 | 324.217 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.31 | 8.67 | -110.01 | 3 | 2 | 2 | 31 | 325.225 | 5 | ↓ |