General Information of the Compound
| Compound ID |
CP0449994
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| Compound Name |
US9163015, 47
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| Structure |
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| Formula |
C11H7Cl2N5
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| Molecular Weight |
280.118
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| Canonical SMILES |
Clc1cc(Nc2n[nH]c3cccnc23)cnc1Cl
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| InChI |
InChI=1S/C11H7Cl2N5/c12-7-4-6(5-15-10(7)13)16-11-9-8(17-18-11)2-1-3-14-9/h1-5H,(H2,16,17,18)
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| InChIKey |
KXTRQQLWYCGLOI-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