| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2008 | 15 | Yes |
Popular Name: 7-Ethyl theophylline 7-Ethyl theophylline
Find On: PubMed — Wikipedia — Google
CAS Number: 23043-88-1
| 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) | 0.44 | 5.83 | -11.26 | 0 | 6 | 0 | 62 | 208.221 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.44 | 6.3 | -46.69 | 1 | 6 | 1 | 63 | 209.229 | 1 | ↓ |
