General Information of the Compound
| Compound ID |
CP0437688
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| Compound Name |
N-[2-(4-propan-2-ylsulfonylpiperazin-1-yl)ethyl]-4-pyridin-2-yl-1,3-thiazol-2-amine
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| Structure |
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| Formula |
C17H25N5O2S2
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| Molecular Weight |
395.554
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| Canonical SMILES |
CC(C)S(=O)(=O)N1CCN(CCNc2nc(cs2)-c2ccccn2)CC1
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| InChI |
InChI=1S/C17H25N5O2S2/c1-14(2)26(23,24)22-11-9-21(10-12-22)8-7-19-17-20-16(13-25-17)15-5-3-4-6-18-15/h3-6,13-14H,7-12H2,1-2H3,(H,19,20)
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| InChIKey |
IDEXWQHLEANJJW-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