| ID | 2056 |
| Name | Drotavarine-theophylline-7-acetate |
| Pubchem ID | 124905 |
| KEGG ID | N/A |
| Source | N/A |
| Type | Unknown |
| Function | Unknown |
| Drug Like Properties | No |
| Molecular Weight | 635.71 |
| Exact mass | 635.295513 |
| Molecular formula | C33H41N5O8 |
| XlogP | N/A |
| Topological Polar Surface Area | 145 |
| H-Bond Donor | 1 |
| H-Bond Acceptor | 10 |
| Rotational Bond Count | 12 |
| IUPAC Name | 1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydroisoquinoline;2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid |
| Structure | |
| SDF file | |
| MOL file | |
| PDB file | |
| Canonical SMILE | CCOC1=C(C=C(C=C1)CC2=NCCC3=CC(=C(C=C32)OCC)OCC)OCC.CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)O |
| Isomeric SMILE | N/A |
| Drugpedia | wiki |
| References | 1. Source 2. Function 3. All Records |