General Information of the Compound
| Compound ID |
CP0572412
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| Compound Name |
US9255103, 29
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| Structure |
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| Formula |
C19H17ClN4O2
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| Molecular Weight |
368.824
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| Canonical SMILES |
Clc1cccnc1C(=O)N1CCn2nc(COc3ccccc3)cc2C1
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| InChI |
InChI=1S/C19H17ClN4O2/c20-17-7-4-8-21-18(17)19(25)23-9-10-24-15(12-23)11-14(22-24)13-26-16-5-2-1-3-6-16/h1-8,11H,9-10,12-13H2
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| InChIKey |
SOSSXRFTYYNKND-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