General Information of the Compound
| Compound ID |
CP0688569
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| Compound Name |
4-(3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-2-(5-fluoro-6-methoxypyridin-3-ylamino)imidazo[1,2-a]pyridin-6-yl)-N,N-dimethylpiperazine-1-carboxamide
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| Structure |
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| Formula |
C24H28FN11O2
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| Molecular Weight |
521.561
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| Canonical SMILES |
COc1ncc(Nc2nc3ccc(N4CCN(C(=O)N(C)C)CC4)cn3c2-c2nc(C)nc(N)n2)cc1F
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| InChI |
InChI=1S/C24H28FN11O2/c1-14-28-20(32-23(26)29-14)19-21(30-15-11-17(25)22(38-4)27-12-15)31-18-6-5-16(13-36(18)19)34-7-9-35(10-8-34)24(37)33(2)3/h5-6,11-13,30H,7-10H2,1-4H3,(H2,26,28,29,32)
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| InChIKey |
DSSCANDYWLGILC-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