General Information of the Compound
| Compound ID |
CP0557519
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| Compound Name |
US9163015, 81
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| Structure |
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| Formula |
C18H12Cl2N4O
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| Molecular Weight |
371.227
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| Canonical SMILES |
Clc1ccc(Oc2ccc(Nc3n[nH]c4cccnc34)cc2Cl)cc1
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| InChI |
InChI=1S/C18H12Cl2N4O/c19-11-3-6-13(7-4-11)25-16-8-5-12(10-14(16)20)22-18-17-15(23-24-18)2-1-9-21-17/h1-10H,(H2,22,23,24)
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| InChIKey |
OBHHDJWXDSZVMF-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