General Information of the Compound
| Compound ID |
CP0885786
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| Compound Name |
SID22410812
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| Structure |
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| Formula |
C22H25N3O3S
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| Molecular Weight |
411.527
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| Canonical SMILES |
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)Cc1c[nH]c2ccccc12
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| InChI |
InChI=1S/C22H25N3O3S/c1-16-9-10-18(29(27,28)25-11-5-2-6-12-25)14-21(16)24-22(26)13-17-15-23-20-8-4-3-7-19(17)20/h3-4,7-10,14-15,23H,2,5-6,11-13H2,1H3,(H,24,26)
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| InChIKey |
QWRUHLGPFKOEIB-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