General Information of the Compound
| Compound ID |
CP0153850
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| Compound Name |
6-cyclopentyloxy-7-methoxy-1-phenyl-N-[2-(trifluoromethoxy)phenyl]-3,4-dihydroisoquinoline-3-carboxamide
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| Structure |
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| Formula |
C29H27F3N2O4
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| Molecular Weight |
524.539
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| Canonical SMILES |
COc1cc2C(=NC(Cc2cc1OC1CCCC1)C(=O)Nc1ccccc1OC(F)(F)F)c1ccccc1
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| InChI |
InChI=1S/C29H27F3N2O4/c1-36-25-17-21-19(16-26(25)37-20-11-5-6-12-20)15-23(33-27(21)18-9-3-2-4-10-18)28(35)34-22-13-7-8-14-24(22)38-29(30,31)32/h2-4,7-10,13-14,16-17,20,23H,5-6,11-12,15H2,1H3,(H,34,35)
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| InChIKey |
KZKPKVMAYKNNDQ-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