General Information of the Compound
| Compound ID |
CP0568548
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| Compound Name |
1-(8-methyl-1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-[(E)-2-(1,3-thiazol-2-yl)ethenyl]sulfonylurea
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| Structure |
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| Formula |
C19H21N3O3S2
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| Molecular Weight |
403.529
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| Canonical SMILES |
Cc1c2CCCc2c(NC(=O)NS(=O)(=O)\C=C\c2nccs2)c2CCCc12
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| InChI |
InChI=1S/C19H21N3O3S2/c1-12-13-4-2-6-15(13)18(16-7-3-5-14(12)16)21-19(23)22-27(24,25)11-8-17-20-9-10-26-17/h8-11H,2-7H2,1H3,(H2,21,22,23)/b11-8+
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| InChIKey |
BEDBUYKJXPHKDN-DHZHZOJOSA-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