General Information of the Compound
| Compound ID |
CP0498582
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| Compound Name |
6-Chloro-imidazo[2,1-b]thiazole-5-sulfonic acid [1-(2-piperidin-1-yl-ethyl)-1H-indol-5-yl]-amide
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| Structure |
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| Formula |
C20H22ClN5O2S2
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| Molecular Weight |
464.016
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| Canonical SMILES |
Clc1nc2sccn2c1S(=O)(=O)Nc1ccc2n(CCN3CCCCC3)ccc2c1
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| InChI |
InChI=1S/C20H22ClN5O2S2/c21-18-19(26-12-13-29-20(26)22-18)30(27,28)23-16-4-5-17-15(14-16)6-9-25(17)11-10-24-7-2-1-3-8-24/h4-6,9,12-14,23H,1-3,7-8,10-11H2
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| InChIKey |
VRGJFPLLFDBSMA-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