In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 20 | Yes |
Popular Name: [(2R)-5-(5-ethylpyrimidin-2-yl)-7-fluoro-2,3-dihydrobenzofuran-2-yl]methanamine [(2R)-5-(5-ethylpyrimidin-2-yl)-…
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) | 1.77 | 5.31 | -50.11 | 3 | 4 | 1 | 63 | 274.319 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.77 | 4.93 | -8.41 | 2 | 4 | 0 | 61 | 273.311 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.