General Information of the Compound
| Compound ID |
CP0953483
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| Compound Name |
N-(1,2,3,4-tetrahydro-1-isoquinolinylmethyl)-2-(trifluoromethoxy)benzamide
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| Structure |
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| Formula |
C18H17F3N2O2
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| Molecular Weight |
350.34
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| Canonical SMILES |
O=C(NCC1NCCc2ccccc21)c1ccccc1OC(F)(F)F
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| InChI |
InChI=1S/C18H17F3N2O2/c19-18(20,21)25-16-8-4-3-7-14(16)17(24)23-11-15-13-6-2-1-5-12(13)9-10-22-15/h1-8,15,22H,9-11H2,(H,23,24)
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| InChIKey |
PNLOCUSZOMGMIJ-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