General Information of the Compound
| Compound ID |
CP0744330
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| Compound Name |
SID49716857
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| Structure |
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| Formula |
C24H33N3O5S
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| Molecular Weight |
475.611
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| Canonical SMILES |
CCOc1ccccc1/C=C/c1onc(C)c1S(=O)(=O)N1CCC(C(=O)N(CC)CC)CC1
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| InChI |
InChI=1S/C24H33N3O5S/c1-5-26(6-2)24(28)20-14-16-27(17-15-20)33(29,30)23-18(4)25-32-22(23)13-12-19-10-8-9-11-21(19)31-7-3/h8-13,20H,5-7,14-17H2,1-4H3/b13-12+
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| InChIKey |
HSPHQJBBYPWGKW-OUKQBFOZSA-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