General Information of the Compound
| Compound ID |
CP0518977
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| Compound Name |
US9200001, 99
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| Structure |
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| Formula |
C19H19N7
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| Molecular Weight |
345.41
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| Canonical SMILES |
Cc1nc(C)n(n1)-c1cc(CCc2ccc3ncccc3n2)nc(C)n1
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| InChI |
InChI=1S/C19H19N7/c1-12-22-16(11-19(23-12)26-14(3)21-13(2)25-26)7-6-15-8-9-17-18(24-15)5-4-10-20-17/h4-5,8-11H,6-7H2,1-3H3
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| InChIKey |
QENWVAPADFUHDD-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