General Information of the Compound
| Compound ID |
CP0087589
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| Compound Name |
N-[3-(7H-purin-6-yl)pyridin-2-yl]-1H-indazol-4-amine
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| Structure |
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| Formula |
C17H12N8
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| Molecular Weight |
328.339
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| Canonical SMILES |
N(c1cccc2n[nH]cc12)c1ncccc1-c1ncnc2nc[nH]c12
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| InChI |
InChI=1S/C17H12N8/c1-4-12(11-7-23-25-13(11)5-1)24-16-10(3-2-6-18-16)14-15-17(21-8-19-14)22-9-20-15/h1-9H,(H,18,24)(H,23,25)(H,19,20,21,22)
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| InChIKey |
OSWNLJFEDVBKFP-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
Protein ID: PT01045, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
Protein ID: PT01033, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform
Protein ID: PT00999, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
Protein ID: PT01029, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform