General Information of the Compound
| Compound ID |
CP0562667
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| Compound Name |
US8901315, 266
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| Structure |
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| Formula |
C24H30N4O4S2
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| Molecular Weight |
502.662
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| Canonical SMILES |
Cc1nn(C2CCCCC2)c2sc(cc12)C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCC(O)CC1
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| InChI |
InChI=1S/C24H30N4O4S2/c1-16-21-15-22(33-24(21)28(26-16)18-5-3-2-4-6-18)23(30)25-17-7-9-20(10-8-17)34(31,32)27-13-11-19(29)12-14-27/h7-10,15,18-19,29H,2-6,11-14H2,1H3,(H,25,30)
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| InChIKey |
UIHQKQYSDRTJJI-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