In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2006 | 21 | Yes |
Popular Name: 10-ethyl-4-methyl-8-(4-pyridyl)-2,4,7,9,10-pentazabicyclo[4.4.0]deca-1,6,8-triene-3,5-dione 10-ethyl-4-methyl-8-(4-pyridyl)-…
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) | 0.97 | 3.8 | -11.36 | 0 | 8 | 0 | 96 | 284.279 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.97 | 4.26 | -48.5 | 1 | 8 | 1 | 97 | 285.287 | 2 | ↓ |