General Information of the Compound
| Compound ID |
CP0265668
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| Compound Name |
4-(cyclohexylmethylamino)-6-pyridin-3-ylquinoline-3-carboxamide
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| Structure |
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| Formula |
C22H24N4O
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| Molecular Weight |
360.461
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| Canonical SMILES |
NC(=O)c1cnc2ccc(cc2c1NCC1CCCCC1)-c1cccnc1
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| InChI |
InChI=1S/C22H24N4O/c23-22(27)19-14-25-20-9-8-16(17-7-4-10-24-13-17)11-18(20)21(19)26-12-15-5-2-1-3-6-15/h4,7-11,13-15H,1-3,5-6,12H2,(H2,23,27)(H,25,26)
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| InChIKey |
JKADCYKTYYGDKT-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: PT01902, Serine-protein kinase ATM
Protein ID: PT01934, Serine/threonine-protein kinase ATR