General Information of the Compound
| Compound ID |
CP0488764
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| Compound Name |
US8993586, 38
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| Structure |
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| Formula |
C24H28N6O2
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| Molecular Weight |
432.528
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| Canonical SMILES |
CNc1cc2ccc(cc2cn1)C(=O)N1CCC2(CC1)Cc1cnn(C(C)C)c1C(=O)N2
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| InChI |
InChI=1S/C24H28N6O2/c1-15(2)30-21-19(14-27-30)12-24(28-22(21)31)6-8-29(9-7-24)23(32)17-5-4-16-11-20(25-3)26-13-18(16)10-17/h4-5,10-11,13-15H,6-9,12H2,1-3H3,(H,25,26)(H,28,31)
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| InChIKey |
YIDPMDKTAUFPNY-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound