General Information of the Compound
| Compound ID |
CP0114932
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| Compound Name |
3-[8-(3,4-dimethoxyanilino)imidazo[1,2-a]pyrazin-6-yl]-N-[4-(1H-pyrazol-4-yl)phenyl]benzamide
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| Structure |
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| Formula |
C30H25N7O3
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| Molecular Weight |
531.576
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| Canonical SMILES |
COc1ccc(Nc2nc(cn3ccnc23)-c2cccc(c2)C(=O)Nc2ccc(cc2)-c2cn[nH]c2)cc1OC
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| InChI |
InChI=1S/C30H25N7O3/c1-39-26-11-10-24(15-27(26)40-2)34-28-29-31-12-13-37(29)18-25(36-28)20-4-3-5-21(14-20)30(38)35-23-8-6-19(7-9-23)22-16-32-33-17-22/h3-18H,1-2H3,(H,32,33)(H,34,36)(H,35,38)
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| InChIKey |
CYTGPIKLVMNZAW-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