General Information of the Compound
| Compound ID |
CP0570255
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| Compound Name |
US10562910, Example 2
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| Structure |
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| Formula |
C26H18Cl2N2O6
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| Molecular Weight |
525.344
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| Canonical SMILES |
OC(=O)c1ccc2OCc3nc(OCc4c(onc4-c4c(Cl)cccc4Cl)C4CC4)ccc3Oc2c1
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| InChI |
InChI=1S/C26H18Cl2N2O6/c27-16-2-1-3-17(28)23(16)24-15(25(36-30-24)13-4-5-13)11-34-22-9-8-19-18(29-22)12-33-20-7-6-14(26(31)32)10-21(20)35-19/h1-3,6-10,13H,4-5,11-12H2,(H,31,32)
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| InChIKey |
QCIKADXJBBMAHM-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