General Information of the Compound
| Compound ID |
CP0496113
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| Compound Name |
3,5-dimethyl-N-[5-[(4-pyridin-2-yl-1,3-thiazol-2-yl)amino]pentyl]-1,2-oxazole-4-sulfonamide
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| Structure |
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| Formula |
C18H23N5O3S2
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| Molecular Weight |
421.548
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| Canonical SMILES |
Cc1noc(C)c1S(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1
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| InChI |
InChI=1S/C18H23N5O3S2/c1-13-17(14(2)26-23-13)28(24,25)21-11-6-3-5-10-20-18-22-16(12-27-18)15-8-4-7-9-19-15/h4,7-9,12,21H,3,5-6,10-11H2,1-2H3,(H,20,22)
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| InChIKey |
JQRAGQZTBUWXPB-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