General Information of the Compound
| Compound ID |
CP0308553
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| Compound Name |
1-[methyl(prop-2-ynyl)amino]-3-naphthalen-2-yloxypropan-2-ol
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| Structure |
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| Formula |
C17H19NO2
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| Molecular Weight |
269.344
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| Canonical SMILES |
CN(CC#C)CC(O)COc1ccc2ccccc2c1
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| InChI |
InChI=1S/C17H19NO2/c1-3-10-18(2)12-16(19)13-20-17-9-8-14-6-4-5-7-15(14)11-17/h1,4-9,11,16,19H,10,12-13H2,2H3
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| InChIKey |
QHFWHRMXZYFRNE-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