General Information of the Compound
| Compound ID |
CP0442585
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| Compound Name |
2-(9-Bromo-3,6,7,8-tetrahydro-2H-furo[2,3-g]chromen-4-yl)ethanamine
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| Structure |
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| Formula |
C13H16BrNO2
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| Molecular Weight |
298.18
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| Canonical SMILES |
NCCc1c2CCOc2c(Br)c2CCCOc12
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| InChI |
InChI=1S/C13H16BrNO2/c14-11-10-2-1-6-16-12(10)8(3-5-15)9-4-7-17-13(9)11/h1-7,15H2
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| InChIKey |
KMZDCEBLJLWKDZ-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