In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 20 | Yes |
Popular Name: 1,6-dimethyl-3-(4-pyridyl)pyrimido[5,4-e][1,2,4]triazine-5,7-quinone 1,6-dimethyl-3-(4-pyridyl)pyrimi…
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) | 0.59 | 2.82 | -11.99 | 0 | 8 | 0 | 96 | 270.252 | 1 | ↓ |
Lo Low (pH 4.5-6) | -3.15 | 3.1 | -50.14 | 1 | 8 | 1 | 97 | 271.26 | 0 | ↓ |
Lo Low (pH 4.5-6) | -3.15 | 3.17 | -154.37 | 2 | 8 | 2 | 98 | 272.268 | 0 | ↓ |