General Information of the Compound
| Compound ID |
CP0518457
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| Compound Name |
US9409917, 46
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| Structure |
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| Formula |
C15H13ClN2O2
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| Molecular Weight |
288.734
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| Canonical SMILES |
Clc1ccc(CNC(=O)C2COc3ncccc23)cc1
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| InChI |
InChI=1S/C15H13ClN2O2/c16-11-5-3-10(4-6-11)8-18-14(19)13-9-20-15-12(13)2-1-7-17-15/h1-7,13H,8-9H2,(H,18,19)
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| InChIKey |
FMOPHLXDWYWPJV-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