In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 20 | Yes |
Popular Name: [3-[(1S,2R)-2-amino-1-(4-fluorophenyl)propoxy]phenyl]methanol [3-[(1S,2R)-2-amino-1-(4-fluorop…
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) | 2.26 | 3.66 | -50.82 | 4 | 3 | 1 | 57 | 276.331 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.26 | 3.33 | -6.47 | 3 | 3 | 0 | 55 | 275.323 | 5 | ↓ |