General Information of the Compound
| Compound ID |
CP0460653
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| Compound Name |
6-[2-(cyclopropylmethylamino)pyridin-4-yl]-N-[1-methyl-3-(pyridin-4-ylmethylcarbamoyl)pyrazol-4-yl]pyridine-2-carboxamide
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| Structure |
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| Formula |
C26H26N8O2
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| Molecular Weight |
482.548
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| Canonical SMILES |
Cn1cc(NC(=O)c2cccc(n2)-c2ccnc(NCC3CC3)c2)c(n1)C(=O)NCc1ccncc1
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| InChI |
InChI=1S/C26H26N8O2/c1-34-16-22(24(33-34)26(36)30-15-18-7-10-27-11-8-18)32-25(35)21-4-2-3-20(31-21)19-9-12-28-23(13-19)29-14-17-5-6-17/h2-4,7-13,16-17H,5-6,14-15H2,1H3,(H,28,29)(H,30,36)(H,32,35)
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| InChIKey |
ZRASKGLAQBRKQL-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