General Information of the Compound
| Compound ID |
CP0557745
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| Compound Name |
US8980938, 5
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| Structure |
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| Formula |
C25H31NO4
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| Molecular Weight |
409.526
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| Canonical SMILES |
CC(C)(NC(=O)c1ccc2CCCCc2c1OCCCCc1ccccc1)C(O)=O
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| InChI |
InChI=1S/C25H31NO4/c1-25(2,24(28)29)26-23(27)21-16-15-19-13-6-7-14-20(19)22(21)30-17-9-8-12-18-10-4-3-5-11-18/h3-5,10-11,15-16H,6-9,12-14,17H2,1-2H3,(H,26,27)(H,28,29)
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| InChIKey |
UUEHRDAKFQMJOI-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