In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 20 | Yes |
Popular Name: (1S)-2-[[(1R)-1-(3-bromo-4-fluoro-phenyl)ethyl]amino]-1-phenyl-ethanol (1S)-2-[[(1R)-1-(3-bromo-4-fluor…
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) | 3.77 | 6.04 | -5.72 | 2 | 2 | 0 | 32 | 338.22 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.77 | 7.2 | -50.55 | 3 | 2 | 1 | 37 | 339.228 | 5 | ↓ |