General Information of the Compound
| Compound ID |
CP0010773
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| Compound Name |
US10307413, Compound 28
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| Structure |
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| Formula |
C23H31N3O3
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| Molecular Weight |
397.519
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| Canonical SMILES |
CN(C)CCOc1cccc(c1)C(=O)NCC(O)CN1CCc2ccccc2C1
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| InChI |
InChI=1S/C23H31N3O3/c1-25(2)12-13-29-22-9-5-8-19(14-22)23(28)24-15-21(27)17-26-11-10-18-6-3-4-7-20(18)16-26/h3-9,14,21,27H,10-13,15-17H2,1-2H3,(H,24,28)
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| InChIKey |
JGIHPUJYYYKYIG-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