General Information of the Compound
| Compound ID |
CP0393248
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| Compound Name |
US9434725, 180
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| Structure |
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| Formula |
C19H20N8
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| Molecular Weight |
360.425
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| Canonical SMILES |
C1CNCCN(C1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cn[nH]c1
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| InChI |
InChI=1S/C19H20N8/c1-3-18(26-7-2-5-20-6-8-26)25-19(4-1)27-17-9-16(14-11-22-23-12-14)21-10-15(17)13-24-27/h1,3-4,9-13,20H,2,5-8H2,(H,22,23)
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| InChIKey |
CYOQMLSODZDBGH-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