General Information of the Compound
| Compound ID |
CP0568754
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| Compound Name |
3-chloro-5-methoxy-N-[(R)-(2-methyl-2-azabicyclo[2.2.2]octan-1-yl)-phenylmethyl]pyridine-4-carboxamide
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| Structure |
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| Formula |
C22H26ClN3O2
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| Molecular Weight |
399.922
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| Canonical SMILES |
COc1cncc(Cl)c1C(=O)N[C@H](c1ccccc1)C12CCC(CC1)CN2C
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| InChI |
InChI=1S/C22H26ClN3O2/c1-26-14-15-8-10-22(26,11-9-15)20(16-6-4-3-5-7-16)25-21(27)19-17(23)12-24-13-18(19)28-2/h3-7,12-13,15,20H,8-11,14H2,1-2H3,(H,25,27)/t15?,20-,22?/m1/s1
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| InChIKey |
OQAQRRFSDZRMCK-YOMPXFNTSA-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