General Information of the Compound
| Compound ID |
CP0556458
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| Compound Name |
US8993565, 20
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| Structure |
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| Formula |
C18H20N4O5
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| Molecular Weight |
372.381
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| Canonical SMILES |
COC(=O)c1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
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| InChI |
InChI=1S/C18H20N4O5/c1-26-18(25)12-3-2-4-13(9-12)19-16(23)10-14-20-15(11-17(24)21-14)22-5-7-27-8-6-22/h2-4,9,11H,5-8,10H2,1H3,(H,19,23)(H,20,21,24)
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| InChIKey |
UJJLMGVFHFWZJS-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