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Duplicate ID | |
---|---|
Smiles | COc1ccc(cc1)CCC(=O)NCCn1ncc2c1ncnc2NCc1ccc(cc1)F |
Cas Number | 1170030-03-1 |
InchiKey | PCJWZSJAAIYILU-UHFFFAOYSA-N |
InChi | InChI=1S/C24H25FN6O2/c1-33-20-9-4-17(5-10-20)6-11-22(32)26-12-13-31-24-21(15-30-31)23(28-16-29-24)27-14-18-2-7-19(25)8-3-18/h2-5,7-10,15-16H,6,11-14H2,1H3,(H,26,32)(H,27,28,29) |
Formula | C24H25FN6O2 |
Molecular weight | 448.493 |
Rings | 4 |
logP | 3.799 |
PSA | 93.96 |
MR | 123.544 |