General Information of the Compound
| Compound ID |
CP0912115
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| Compound Name |
N-(2,6-difluorophenyl)-3-[3-(2-{[2-(methyloxy)-4-(4-morpholinyl)phenyl]amino}-4-pyrimidinyl)imidazo[1,2-a]pyridin-2-yl]benzamide
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| Structure |
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| Formula |
C35H29F2N7O3
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| Molecular Weight |
633.659
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| Canonical SMILES |
COc1cc(N2CCOCC2)ccc1Nc1nccc(-c2c(-c3cccc(C(=O)Nc4c(F)cccc4F)c3)nc3ccccn23)n1
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| InChI |
InChI=1S/C35H29F2N7O3/c1-46-29-21-24(43-16-18-47-19-17-43)11-12-27(29)39-35-38-14-13-28(40-35)33-31(41-30-10-2-3-15-44(30)33)22-6-4-7-23(20-22)34(45)42-32-25(36)8-5-9-26(32)37/h2-15,20-21H,16-19H2,1H3,(H,42,45)(H,38,39,40)
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| InChIKey |
MZIRRPYGJKSMOV-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