General Information of the Compound
| Compound ID |
CP0514764
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| Compound Name |
CHEMBL522788
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| Formula |
C20H16Cl2N2O2
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| Molecular Weight |
387.266
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| Canonical SMILES |
Clc1cc2nc([nH]c2cc1Cl)[C@H]1CC[C@@]2(CC1)OC(=O)c1ccccc21
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| InChI |
InChI=1S/C20H16Cl2N2O2/c21-14-9-16-17(10-15(14)22)24-18(23-16)11-5-7-20(8-6-11)13-4-2-1-3-12(13)19(25)26-20/h1-4,9-11H,5-8H2,(H,23,24)/t11-,20-
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| InChIKey |
ZQGUJFGLBWYEBD-YLCJPNJKSA-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