General Information of the Compound
| Compound ID |
CP0556249
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| Compound Name |
US8889724, EC
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| Structure |
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| Formula |
C17H18N4O
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| Molecular Weight |
294.358
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| Canonical SMILES |
Cc1cccc(C)c1COc1cccc(Cc2nnn[nH]2)c1
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| InChI |
InChI=1S/C17H18N4O/c1-12-5-3-6-13(2)16(12)11-22-15-8-4-7-14(9-15)10-17-18-20-21-19-17/h3-9H,10-11H2,1-2H3,(H,18,19,20,21)
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| InChIKey |
KJVQFGWUVANOSW-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