General Information of the Compound
| Compound ID |
CP0487807
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| Compound Name |
3-[1-(4-chlorophenyl)cyclopropyl]-8-phenoxy-[1,2,4]triazolo[4,3-a]pyridine
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| Structure |
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| Formula |
C21H16ClN3O
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| Molecular Weight |
361.832
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| Canonical SMILES |
Clc1ccc(cc1)C1(CC1)c1nnc2c(Oc3ccccc3)cccn12
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| InChI |
InChI=1S/C21H16ClN3O/c22-16-10-8-15(9-11-16)21(12-13-21)20-24-23-19-18(7-4-14-25(19)20)26-17-5-2-1-3-6-17/h1-11,14H,12-13H2
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| InChIKey |
ULRAWWVMQFIUCW-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