In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2009 | 19 | Yes |
Popular Name: (1S)-2-[(3-bromo-4-fluoro-phenyl)methylamino]-1-phenyl-ethanol (1S)-2-[(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) | 3.21 | 5.23 | -6.07 | 2 | 2 | 0 | 32 | 324.193 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.21 | 6.58 | -52.61 | 3 | 2 | 1 | 37 | 325.201 | 5 | ↓ |