| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 22nd, 2008 | 26 | Yes |
Popular Name: 7-butyl-3-methyl-8-(3-phenylpropylsulfanyl)purine-2,6-dione 7-butyl-3-methyl-8-(3-phenylprop…
| 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) | 3.73 | 10.92 | -8.85 | 1 | 6 | 0 | 73 | 372.494 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.73 | 11.38 | -40.09 | 2 | 6 | 1 | 74 | 373.502 | 8 | ↓ |
