General Information of the Compound
| Compound ID |
CP0374279
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| Compound Name |
CHEMBL277064
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| Formula |
C25H30N2O3
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| Molecular Weight |
406.526
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| Canonical SMILES |
COc1ccccc1C(=O)NC[C@@]1(CC[C@@H](CC1)NC(=O)\C=C\C)c1ccccc1
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| InChI |
InChI=1S/C25H30N2O3/c1-3-9-23(28)27-20-14-16-25(17-15-20,19-10-5-4-6-11-19)18-26-24(29)21-12-7-8-13-22(21)30-2/h3-13,20H,14-18H2,1-2H3,(H,26,29)(H,27,28)/b9-3+/t20-,25-
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| InChIKey |
AXDJCFLQRCIEQQ-ZVAUEBCSSA-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