In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 8th, 2006 | 22 | Yes |
Popular Name: 5-(3,4-dimethoxyphenyl)-8-methyl-2,4,8-triazabicyclo[4.3.0]non-10-ene-3,7-dione 5-(3,4-dimethoxyphenyl)-8-methyl…
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) | 0.62 | 2.36 | -17.64 | 2 | 7 | 0 | 80 | 303.318 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.24 | 0.63 | -52.16 | 3 | 7 | 1 | 85 | 304.326 | 3 | ↓ |