General Information of the Compound
| Compound ID |
CP0509256
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| Compound Name |
N-(1-azabicyclo[2.2.2]octan-4-ylmethyl)-2-(4-chloro-1,3-thiazol-2-yl)benzamide
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| Structure |
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| Formula |
C18H20ClN3OS
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| Molecular Weight |
361.898
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| Canonical SMILES |
Clc1csc(n1)-c1ccccc1C(=O)NCC12CCN(CC1)CC2
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| InChI |
InChI=1S/C18H20ClN3OS/c19-15-11-24-17(21-15)14-4-2-1-3-13(14)16(23)20-12-18-5-8-22(9-6-18)10-7-18/h1-4,11H,5-10,12H2,(H,20,23)
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| InChIKey |
RFNHQDSZIYDXKH-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