General Information of the Compound
| Compound ID |
CP0374513
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| Compound Name |
N-(2,6-difluorophenyl)-3-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-2-yl]benzamide
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| Structure |
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| Formula |
C32H22F2N6O3
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| Molecular Weight |
576.563
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| Canonical SMILES |
Fc1cccc(F)c1NC(=O)c1cccc(c1)-c1nc2ccccn2c1-c1ccnc(Nc2ccc3OCCOc3c2)n1
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| InChI |
InChI=1S/C32H22F2N6O3/c33-22-7-4-8-23(34)29(22)39-31(41)20-6-3-5-19(17-20)28-30(40-14-2-1-9-27(40)38-28)24-12-13-35-32(37-24)36-21-10-11-25-26(18-21)43-16-15-42-25/h1-14,17-18H,15-16H2,(H,39,41)(H,35,36,37)
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| InChIKey |
NPCWIWWZAAGQHQ-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