General Information of the Compound
| Compound ID |
CP0895724
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| Compound Name |
N-(2,6-difluorophenyl)-5-(3-(2-(3-(2-(dimethylamino)ethoxy)phenylamino)pyrimidin-4-yl)-7-methylimidazo[1,2-a]pyridin-2-yl)-2-methoxybenzamide
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| Structure |
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| Formula |
C36H33F2N7O3
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| Molecular Weight |
649.702
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| Canonical SMILES |
COc1ccc(-c2nc3cc(C)ccn3c2-c2ccnc(Nc3cccc(OCCN(C)C)c3)n2)cc1C(=O)Nc1c(F)cccc1F
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| InChI |
InChI=1S/C36H33F2N7O3/c1-22-14-16-45-31(19-22)42-32(23-11-12-30(47-4)26(20-23)35(46)43-33-27(37)9-6-10-28(33)38)34(45)29-13-15-39-36(41-29)40-24-7-5-8-25(21-24)48-18-17-44(2)3/h5-16,19-21H,17-18H2,1-4H3,(H,43,46)(H,39,40,41)
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| InChIKey |
NXMXMEFBPNRJRR-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
Protein ID: PT01101, Insulin receptor
Protein ID: PT01104, Insulin-like growth factor 1 receptor