General Information of the Compound
| Compound ID |
CP0191136
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| Compound Name |
2-((2-methoxyethyl)(methyl)amino)-2-phenyl-1,1-di(pyridin-3-yl)ethanol
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| Structure |
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| Formula |
C22H25N3O2
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| Molecular Weight |
363.461
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| Canonical SMILES |
COCCN(C)C(c1ccccc1)C(O)(c1cccnc1)c1cccnc1
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| InChI |
InChI=1S/C22H25N3O2/c1-25(14-15-27-2)21(18-8-4-3-5-9-18)22(26,19-10-6-12-23-16-19)20-11-7-13-24-17-20/h3-13,16-17,21,26H,14-15H2,1-2H3
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| InChIKey |
XRELUBWLPZIXSQ-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