General Information of the Compound
| Compound ID |
CP0353986
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| Compound Name |
8-(4-chlorophenoxy)-3-[1-(4-chlorophenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridine
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| Structure |
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| Formula |
C21H15Cl2N3O
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| Molecular Weight |
396.277
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| Canonical SMILES |
Clc1ccc(Oc2cccn3c(nnc23)C2(CC2)c2ccc(Cl)cc2)cc1
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| InChI |
InChI=1S/C21H15Cl2N3O/c22-15-5-3-14(4-6-15)21(11-12-21)20-25-24-19-18(2-1-13-26(19)20)27-17-9-7-16(23)8-10-17/h1-10,13H,11-12H2
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| InChIKey |
MBDMAPPPOSTTSN-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