General Information of the Compound
| Compound ID |
CP0924854
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| Compound Name |
N-methyl-N-(5-(3-trifluoromethoxyphenyl)-furan-2-yl-methyl)ethylenediamine hydrochloride
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| Structure |
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| Formula |
C15H18ClF3N2O2
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| Molecular Weight |
350.768
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| Canonical SMILES |
CN(CCN)Cc1ccc(-c2cccc(OC(F)(F)F)c2)o1.Cl
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| InChI |
InChI=1S/C15H17F3N2O2.ClH/c1-20(8-7-19)10-13-5-6-14(21-13)11-3-2-4-12(9-11)22-15(16,17)18;/h2-6,9H,7-8,10,19H2,1H3;1H
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| InChIKey |
BSIWYUPOGQGMHF-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