General Information of the Compound
| Compound ID |
CP0237477
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| Compound Name |
US8575201, 134
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| Structure |
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| Formula |
C19H18N8O
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| Molecular Weight |
374.408
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| Canonical SMILES |
Cn1cc(cn1)-c1nc(no1)C1(CCC1)c1ccc(cn1)-c1cnc(N)nc1
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| InChI |
InChI=1S/C19H18N8O/c1-27-11-14(10-24-27)16-25-17(26-28-16)19(5-2-6-19)15-4-3-12(7-21-15)13-8-22-18(20)23-9-13/h3-4,7-11H,2,5-6H2,1H3,(H2,20,22,23)
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| InChIKey |
NCKPUAHDRNNIHZ-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