General Information of the Compound
| Compound ID |
CP0571837
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| Compound Name |
1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-[(E)-2-(4-methyl-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 |
Cc1csc(\C=C\S(=O)(=O)NC(=O)Nc2c3CCCc3cc3CCCc23)n1
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| InChI |
InChI=1S/C19H21N3O3S2/c1-12-11-26-17(20-12)8-9-27(24,25)22-19(23)21-18-15-6-2-4-13(15)10-14-5-3-7-16(14)18/h8-11H,2-7H2,1H3,(H2,21,22,23)/b9-8+
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| InChIKey |
NACJGIPXBWHPJD-CMDGGOBGSA-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