General Information of the Compound
| Compound ID |
CP0466708
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| Compound Name |
US10202399, Example 15
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| Structure |
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| Formula |
C18H16N2O2
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| Molecular Weight |
292.338
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| Canonical SMILES |
Oc1cc(CCc2ccc(cc2)-c2ccccc2)n[nH]c1=O
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| InChI |
InChI=1S/C18H16N2O2/c21-17-12-16(19-20-18(17)22)11-8-13-6-9-15(10-7-13)14-4-2-1-3-5-14/h1-7,9-10,12H,8,11H2,(H,19,21)(H,20,22)
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| InChIKey |
IZGUGWLAGDSDBC-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