General Information of the Compound
| Compound ID |
CP0228168
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| Compound Name |
US9353093, 8
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| Structure |
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| Formula |
C23H20N4O3
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| Molecular Weight |
400.438
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| Canonical SMILES |
COc1cccc(NC(=O)Nc2ccc(cc2)-c2cc3ccccc3n2C(N)=O)c1
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| InChI |
InChI=1S/C23H20N4O3/c1-30-19-7-4-6-18(14-19)26-23(29)25-17-11-9-15(10-12-17)21-13-16-5-2-3-8-20(16)27(21)22(24)28/h2-14H,1H3,(H2,24,28)(H2,25,26,29)
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| InChIKey |
KESUAIOCJKBPRI-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