General Information of the Compound
| Compound ID |
CP0578382
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| Compound Name |
cyclopentyl-[4-[[2-methyl-3-([1,3]thiazolo[5,4-b]pyridin-2-ylamino)phenyl]methyl]piperazin-1-yl]methanone
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| Structure |
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| Formula |
C24H29N5OS
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| Molecular Weight |
435.597
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| Canonical SMILES |
Cc1c(CN2CCN(CC2)C(=O)C2CCCC2)cccc1Nc1nc2cccnc2s1
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| InChI |
InChI=1S/C24H29N5OS/c1-17-19(16-28-12-14-29(15-13-28)23(30)18-6-2-3-7-18)8-4-9-20(17)26-24-27-21-10-5-11-25-22(21)31-24/h4-5,8-11,18H,2-3,6-7,12-16H2,1H3,(H,26,27)
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| InChIKey |
XCLCAIHWZKUQRP-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