General Information of the Compound
| Compound ID |
CP0132927
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| Compound Name |
US8614253, 43-37
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| Structure |
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| Formula |
C17H17NO4
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| Molecular Weight |
299.326
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| Canonical SMILES |
COc1cc(cc(C=O)c1O)-c1cccc(c1)C(=O)N(C)C
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| InChI |
InChI=1S/C17H17NO4/c1-18(2)17(21)12-6-4-5-11(7-12)13-8-14(10-19)16(20)15(9-13)22-3/h4-10,20H,1-3H3
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| InChIKey |
RXHNRHHFIVPMRK-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