General Information of the Compound
| Compound ID |
CP0463812
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| Compound Name |
US8980938, 2
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| Structure |
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| Formula |
C23H33NO4
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| Molecular Weight |
387.52
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| Canonical SMILES |
CC(C)(NC(=O)c1ccc2CCCCc2c1OCCC1CCCCC1)C(O)=O
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| InChI |
InChI=1S/C23H33NO4/c1-23(2,22(26)27)24-21(25)19-13-12-17-10-6-7-11-18(17)20(19)28-15-14-16-8-4-3-5-9-16/h12-13,16H,3-11,14-15H2,1-2H3,(H,24,25)(H,26,27)
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| InChIKey |
RVQOKKHTGALHFH-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