General Information of the Compound
| Compound ID |
CP0444781
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| Compound Name |
N-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-4-phenylbenzamide
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| Structure |
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| Formula |
C26H28N2O3
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| Molecular Weight |
416.521
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| Canonical SMILES |
COc1cc(NC(=O)c2ccc(cc2)-c2ccccc2)ccc1OCCN1CCCC1
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| InChI |
InChI=1S/C26H28N2O3/c1-30-25-19-23(13-14-24(25)31-18-17-28-15-5-6-16-28)27-26(29)22-11-9-21(10-12-22)20-7-3-2-4-8-20/h2-4,7-14,19H,5-6,15-18H2,1H3,(H,27,29)
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| InChIKey |
TVBZXJOQEZLHDL-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