General Information of the Compound
| Compound ID |
CP0557399
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| Compound Name |
4-[8-(3,4-dimethoxyanilino)imidazo[1,2-a]pyrazin-6-yl]benzamide
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| Structure |
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| Formula |
C21H19N5O3
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| Molecular Weight |
389.415
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| Canonical SMILES |
COc1ccc(Nc2nc(cn3ccnc23)-c2ccc(cc2)C(N)=O)cc1OC
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| InChI |
InChI=1S/C21H19N5O3/c1-28-17-8-7-15(11-18(17)29-2)24-20-21-23-9-10-26(21)12-16(25-20)13-3-5-14(6-4-13)19(22)27/h3-12H,1-2H3,(H2,22,27)(H,24,25)
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| InChIKey |
WEXVCVLQLNOQME-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