General Information of the Compound
| Compound ID |
CP0450210
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| Compound Name |
US8993565, 73
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| Structure |
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| Formula |
C18H21FN4O4
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| Molecular Weight |
376.388
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| Canonical SMILES |
COCc1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
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| InChI |
InChI=1S/C18H21FN4O4/c1-26-11-12-8-13(2-3-14(12)19)20-17(24)9-15-21-16(10-18(25)22-15)23-4-6-27-7-5-23/h2-3,8,10H,4-7,9,11H2,1H3,(H,20,24)(H,21,22,25)
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| InChIKey |
FANHUGUJYGOSMO-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