In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2005 | 30 | No |
Popular Name: 2-pyridylmethylBLAHdione 2-pyridylmethylBLAHdione
None
None
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) | 3.49 | 0.47 | -44.1 | 1 | 6 | 1 | 73 | 397.41 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.49 | 0.53 | -117.42 | 2 | 6 | 2 | 75 | 398.418 | 2 | ↓ |