General Information of the Compound
| Compound ID |
CP0093351
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| Compound Name |
US9169260, 131
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| Structure |
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| Formula |
C24H20N6O2
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| Molecular Weight |
424.464
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| Canonical SMILES |
COc1ccc(cc1)-c1cc(NC(=O)c2cnn3cccnc23)n(n1)-c1ccc(C)cc1
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| InChI |
InChI=1S/C24H20N6O2/c1-16-4-8-18(9-5-16)30-22(14-21(28-30)17-6-10-19(32-2)11-7-17)27-24(31)20-15-26-29-13-3-12-25-23(20)29/h3-15H,1-2H3,(H,27,31)
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| InChIKey |
DHRFTZUWHODEQA-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