| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 27th, 2007 | 30 | Yes |
Popular Name: 3-butyl-1-[(4,6-diamino-1,3,5-triazin-2-yl)methyl]-7-(2-furylmethyl)purine-2,6-dione 3-butyl-1-[(4,6-diamino-1,3,5-tr…
| 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) | 1.02 | -3.15 | -18.88 | 4 | 12 | 0 | 165 | 411.426 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.02 | -2.87 | -56.43 | 5 | 12 | 1 | 166 | 412.434 | 7 | ↓ |
