General Information of the Compound
| Compound ID |
CP0380404
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| Compound Name |
CHEMBL16806
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| Formula |
C23H28N2O4
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| Molecular Weight |
396.487
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| Canonical SMILES |
CNC(=O)O[C@H]1CC[C@](CNC(=O)c2ccccc2OC)(CC1)c1ccccc1
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| InChI |
InChI=1S/C23H28N2O4/c1-24-22(27)29-18-12-14-23(15-13-18,17-8-4-3-5-9-17)16-25-21(26)19-10-6-7-11-20(19)28-2/h3-11,18H,12-16H2,1-2H3,(H,24,27)(H,25,26)/t18-,23+
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| InChIKey |
AREGPDFKGNNJAE-QRTMHTFLSA-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