General Information of the Compound
| Compound ID |
CP0326876
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| Compound Name |
US10501467, Example 36
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| Structure |
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| Formula |
C19H22N4O2
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| Molecular Weight |
338.411
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| Canonical SMILES |
O=c1[nH]nc2CCCc3n(CCN4CCOCC4)c4cccc1c4c23
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| InChI |
InChI=1S/C19H22N4O2/c24-19-13-3-1-5-15-17(13)18-14(20-21-19)4-2-6-16(18)23(15)8-7-22-9-11-25-12-10-22/h1,3,5H,2,4,6-12H2,(H,21,24)
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| InChIKey |
WWQMIDHLMQTNRA-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