General Information of the Compound
| Compound ID |
CP0492928
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| Compound Name |
US9434711, 492
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| Structure |
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| Formula |
C24H21NO6S3
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| Molecular Weight |
515.634
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| Canonical SMILES |
Cc1c(sc2ccccc12)N(Cc1ccc(cc1)S(C)(=O)=O)S(=O)(=O)c1ccc(cc1)C(O)=O
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| InChI |
InChI=1S/C24H21NO6S3/c1-16-21-5-3-4-6-22(21)32-23(16)25(15-17-7-11-19(12-8-17)33(2,28)29)34(30,31)20-13-9-18(10-14-20)24(26)27/h3-14H,15H2,1-2H3,(H,26,27)
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| InChIKey |
FGGOQDIYDRABQQ-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