General Information of the Compound
| Compound ID |
CP0465234
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| Compound Name |
1-(2,4-dichlorobenzyl)-N-(5-(diethylamino)pentan-2-yl)-1H-pyrazolo[3,4-b]pyridin-6-amine
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| Structure |
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| Formula |
C22H29Cl2N5
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| Molecular Weight |
434.415
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| Canonical SMILES |
CCN(CC)CCCC(C)Nc1ccc2cnn(Cc3ccc(Cl)cc3Cl)c2n1
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| InChI |
InChI=1S/C22H29Cl2N5/c1-4-28(5-2)12-6-7-16(3)26-21-11-9-17-14-25-29(22(17)27-21)15-18-8-10-19(23)13-20(18)24/h8-11,13-14,16H,4-7,12,15H2,1-3H3,(H,26,27)
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| InChIKey |
WVFBWTWTRQHWIC-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