In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2009 | 18 | Yes |
Popular Name: (1R)-1-[2-fluoro-6-(4-methyl-1,4-diazepan-1-yl)phenyl]ethanol (1R)-1-[2-fluoro-6-(4-methyl-1,4…
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) | 1.83 | 6.92 | -41.71 | 2 | 3 | 1 | 28 | 253.341 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.83 | 4.93 | -4.72 | 1 | 3 | 0 | 27 | 252.333 | 2 | ↓ |