General Information of the Compound
| Compound ID |
CP0947312
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| Compound Name |
N-(2,6-difluorophenyl)-5-{3-[2-({5-fluoro-2-(methyloxy)-4-[2-(4-morpholinyl)ethyl]phenyl}-amino)-4-pyrimidinyl]imidazo[1,2-a]pyridin-2-yl}-2-(methyloxy)benzamide
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| Structure |
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| Formula |
C38H34F3N7O4
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| Molecular Weight |
709.729
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| Canonical SMILES |
COc1cc(CCN2CCOCC2)c(F)cc1Nc1nccc(-c2c(-c3ccc(OC)c(C(=O)Nc4c(F)cccc4F)c3)nc3ccccn23)n1
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| InChI |
InChI=1S/C38H34F3N7O4/c1-50-31-10-9-24(20-25(31)37(49)46-35-26(39)6-5-7-27(35)40)34-36(48-14-4-3-8-33(48)45-34)29-11-13-42-38(43-29)44-30-22-28(41)23(21-32(30)51-2)12-15-47-16-18-52-19-17-47/h3-11,13-14,20-22H,12,15-19H2,1-2H3,(H,46,49)(H,42,43,44)
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| InChIKey |
JWRDQBNZPRQOCL-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