In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2006 | 29 | Yes |
Popular Name: 3-butyl-7-ethyl-8-(2-quinolylsulfanylmethyl)purine-2,6-dione 3-butyl-7-ethyl-8-(2-quinolylsul…
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) | 3.51 | -2.23 | -10.58 | 1 | 7 | 0 | 85 | 409.515 | 7 | ↓ |