| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 26th, 2004 | 25 | No |
Popular Name: 7-[(Z)-3-chlorobut-2-enyl]-8-(cyclohexylamino)-1,3-dimethyl-xanthine 7-[(Z)-3-chlorobut-2-enyl]-8-(cy…
| 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) | 3.38 | -0.22 | -9.36 | 1 | 7 | 0 | 73 | 365.865 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.38 | 0.06 | -37.55 | 2 | 7 | 1 | 75 | 366.873 | 4 | ↓ |
