In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 12th, 2006 | 30 | No |
Popular Name: 7-dodecyl-3-methyl-8-piperidin-1-yl-3,7-dihydro-1H-purine-2,6-dione 7-dodecyl-3-methyl-8-piperidin-1…
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) | 5.86 | -2.17 | -6.62 | 1 | 7 | 0 | 75 | 417.598 | 12 | ↓ |
Mid Mid (pH 6-8) | 5.86 | -1.92 | -34.08 | 2 | 7 | 1 | 77 | 418.606 | 12 | ↓ |