General Information of the Compound
| Compound ID |
CP0490136
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| Compound Name |
US9150519, 1-64
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| Structure |
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| Formula |
C24H33N5O3S
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| Molecular Weight |
471.627
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| Canonical SMILES |
CN(C)S(=O)(=O)c1ccc(NC(=O)c2cc(ncn2)N(CC2CC2)C2CCCCC2)c(C)c1
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| InChI |
InChI=1S/C24H33N5O3S/c1-17-13-20(33(31,32)28(2)3)11-12-21(17)27-24(30)22-14-23(26-16-25-22)29(15-18-9-10-18)19-7-5-4-6-8-19/h11-14,16,18-19H,4-10,15H2,1-3H3,(H,27,30)
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| InChIKey |
XYEPHZZYNOVTKE-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