General Information of the Compound
| Compound ID |
CP0866114
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| Compound Name |
N-(2,6-difluorophenyl)-2-(methyloxy)-5-{3-[2-({2-(methyloxy)-4-[4-(methylsulfonyl)-1-piperazinyl]phenyl}amino)-4-pyrimidinyl]imidazo[1,2-a]pyridin-2-yl}benzamide
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| Structure |
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| Formula |
C37H34F2N8O5S
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| Molecular Weight |
740.793
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| Canonical SMILES |
COc1cc(N2CCN(S(C)(=O)=O)CC2)ccc1Nc1nccc(-c2c(-c3ccc(OC)c(C(=O)Nc4c(F)cccc4F)c3)nc3ccccn23)n1
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| InChI |
InChI=1S/C37H34F2N8O5S/c1-51-30-13-10-23(21-25(30)36(48)44-34-26(38)7-6-8-27(34)39)33-35(47-16-5-4-9-32(47)43-33)29-14-15-40-37(42-29)41-28-12-11-24(22-31(28)52-2)45-17-19-46(20-18-45)53(3,49)50/h4-16,21-22H,17-20H2,1-3H3,(H,44,48)(H,40,41,42)
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| InChIKey |
HQCJUBSNKWZJOI-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