General Information of the Compound
| Compound ID |
CP0563983
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| Compound Name |
US8853203, 58
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| Structure |
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| Formula |
C19H17N3O3
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| Molecular Weight |
335.363
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| Canonical SMILES |
COc1cccc2C3=CC(=NCC(=O)N3CCc12)c1cccc(O)n1
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| InChI |
InChI=1S/C19H17N3O3/c1-25-17-6-2-4-12-13(17)8-9-22-16(12)10-15(20-11-19(22)24)14-5-3-7-18(23)21-14/h2-7,10H,8-9,11H2,1H3,(H,21,23)
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| InChIKey |
DTTSDIMPLNYWCV-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