General Information of the Compound
| Compound ID |
CP0501967
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| Compound Name |
2-[amino(methyl)amino]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanol
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| Structure |
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| Formula |
C11H16N2O3
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| Molecular Weight |
224.26
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| Canonical SMILES |
CN(N)CC(O)c1ccc2OCCOc2c1
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| InChI |
InChI=1S/C11H16N2O3/c1-13(12)7-9(14)8-2-3-10-11(6-8)16-5-4-15-10/h2-3,6,9,14H,4-5,7,12H2,1H3
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| InChIKey |
FOEZTHRTTURWLX-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