In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2009 | 34 | No |
Popular Name: dimethylBLAHdione dimethylBLAHdione
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) | 6.16 | 16.27 | -84.85 | 2 | 4 | 2 | 43 | 472.758 | 0 | ↓ |
Hi High (pH 8-9.5) | 6.16 | 10.64 | -7.25 | 0 | 4 | 0 | 41 | 470.742 | 0 | ↓ |
Hi High (pH 8-9.5) | 6.16 | 13.38 | -41.12 | 1 | 4 | 1 | 42 | 471.75 | 0 | ↓ |