General Information of the Compound
| Compound ID |
CP0504511
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| Compound Name |
N-(2-chlorophenyl)-4-(3-isoquinolin-1-yl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide
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| Structure |
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| Formula |
C23H20ClN5O2
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| Molecular Weight |
433.899
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| Canonical SMILES |
Clc1ccccc1NC(=O)N1CCC(CC1)c1nc(no1)-c1nccc2ccccc12
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| InChI |
InChI=1S/C23H20ClN5O2/c24-18-7-3-4-8-19(18)26-23(30)29-13-10-16(11-14-29)22-27-21(28-31-22)20-17-6-2-1-5-15(17)9-12-25-20/h1-9,12,16H,10-11,13-14H2,(H,26,30)
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| InChIKey |
IPMWETUBBXZFJN-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