General Information of the Compound
| Compound ID |
CP0550575
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| Compound Name |
US8993565, 99
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| Structure |
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| Formula |
C19H21N5O3
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| Molecular Weight |
367.409
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| Canonical SMILES |
Cn1ccc2c(NC(=O)Cc3nc(cc(=O)[nH]3)N3CCOCC3)cccc12
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| InChI |
InChI=1S/C19H21N5O3/c1-23-6-5-13-14(3-2-4-15(13)23)20-18(25)11-16-21-17(12-19(26)22-16)24-7-9-27-10-8-24/h2-6,12H,7-11H2,1H3,(H,20,25)(H,21,22,26)
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| InChIKey |
PIOBNNVDRKELEL-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