General Information of the Compound
| Compound ID |
CP0507266
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| Compound Name |
US9434711, 341
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| Structure |
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| Formula |
C24H31NO4S2
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| Molecular Weight |
461.649
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| Canonical SMILES |
CCCCN(c1sc2ccccc2c1C(C)(C)O)S(=O)(=O)c1ccc(cc1)C(C)(C)O
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| InChI |
InChI=1S/C24H31NO4S2/c1-6-7-16-25(31(28,29)18-14-12-17(13-15-18)23(2,3)26)22-21(24(4,5)27)19-10-8-9-11-20(19)30-22/h8-15,26-27H,6-7,16H2,1-5H3
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| InChIKey |
ASLSRPBFLKHNJA-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