General Information of the Compound
| Compound ID |
CP0966894
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| Compound Name |
SID22409430
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| Structure |
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| Formula |
C21H20Cl2N4O3S3
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| Molecular Weight |
543.523
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| Canonical SMILES |
CCS(=O)(=O)N1Cc2ccccc2CC1C(=O)Nc1nnc(SCc2c(Cl)cccc2Cl)s1
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| InChI |
InChI=1S/C21H20Cl2N4O3S3/c1-2-33(29,30)27-11-14-7-4-3-6-13(14)10-18(27)19(28)24-20-25-26-21(32-20)31-12-15-16(22)8-5-9-17(15)23/h3-9,18H,2,10-12H2,1H3,(H,24,25,28)
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| InChIKey |
GCLQKLXVXMGMQE-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