In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 1st, 2010 | 28 | Yes |
Popular Name: [(1R)-2-[[2-(2,6-dimethylanilino)-2-oxo-ethyl]amino]-1-methyl-2-oxo-ethyl] [(1R)-2-[[2-(2,6-dimethylanilino…
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) | 3.29 | 7.72 | -13.9 | 3 | 7 | 0 | 105 | 404.85 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.29 | 8.73 | -50.07 | 2 | 7 | -1 | 108 | 403.842 | 7 | ↓ |