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| Duplicate ID | |
|---|---|
| Smiles | COc1ccc(cc1)Nc1nc(nc2c1cn[nH]2)N1CCN(CC1)c1ccccc1OC |
| Cas Number | 1105225-36-2 |
| InchiKey | XEMKNVOGYJXJQH-UHFFFAOYSA-N |
| InChi | InChI=1S/C23H25N7O2/c1-31-17-9-7-16(8-10-17)25-21-18-15-24-28-22(18)27-23(26-21)30-13-11-29(12-14-30)19-5-3-4-6-20(19)32-2/h3-10,15H,11-14H2,1-2H3,(H2,24,25,26,27,28) |
| Formula | C23H25N7O2 |
| Molecular weight | 431.49 |
| Rings | 5 |
| logP | 3.6433 |
| PSA | 91.43 |
| MR | 130.709 |