General Information of the Compound
| Compound ID |
CP0390802
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| Compound Name |
2-[4-[4-[(7-pyrazin-2-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)amino]phenyl]piperidin-1-yl]acetamide
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| Structure |
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| Formula |
C23H24N8O
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| Molecular Weight |
428.5
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| Canonical SMILES |
NC(=O)CN1CCC(CC1)c1ccc(Nc2ncc3ccc(-c4cnccn4)n3n2)cc1
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| InChI |
InChI=1S/C23H24N8O/c24-22(32)15-30-11-7-17(8-12-30)16-1-3-18(4-2-16)28-23-27-13-19-5-6-21(31(19)29-23)20-14-25-9-10-26-20/h1-6,9-10,13-14,17H,7-8,11-12,15H2,(H2,24,32)(H,28,29)
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| InChIKey |
CRNDZINQKKIWHU-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