General Information of the Compound
| Compound ID |
CP0567352
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| Compound Name |
US9067871, 20
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| Structure |
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| Formula |
C24H26Cl2N4O4S
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| Molecular Weight |
537.469
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| Canonical SMILES |
Cn1cnc(c1)S(=O)(=O)NCCOc1ccc2CCC(NC=O)C(Cc3ccc(Cl)c(Cl)c3)c2c1
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| InChI |
InChI=1S/C24H26Cl2N4O4S/c1-30-13-24(27-14-30)35(32,33)29-8-9-34-18-5-3-17-4-7-23(28-15-31)20(19(17)12-18)10-16-2-6-21(25)22(26)11-16/h2-3,5-6,11-15,20,23,29H,4,7-10H2,1H3,(H,28,31)
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| InChIKey |
JSDWCARVVZTNCH-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