General Information of the Compound
| Compound ID |
CP0414015
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| Compound Name |
US8772283, 3
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| Structure |
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| Formula |
C26H22FN3O
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| Molecular Weight |
411.48
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| Canonical SMILES |
NC1(CCC1)c1ccc(cc1)-c1nc2-c3c(F)cccc3OCn2c1-c1ccccc1
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| InChI |
InChI=1S/C26H22FN3O/c27-20-8-4-9-21-22(20)25-29-23(17-10-12-19(13-11-17)26(28)14-5-15-26)24(30(25)16-31-21)18-6-2-1-3-7-18/h1-4,6-13H,5,14-16,28H2
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| InChIKey |
WWHZFUWEJSHFEY-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: PT00845, RAC-alpha serine/threonine-protein kinase
Protein ID: PT01131, RAC-beta serine/threonine-protein kinase