General Information of the Compound
| Compound ID |
CP0406166
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| Compound Name |
3-[1-(4-chlorophenyl)cyclopropyl]-8-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridine
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| Structure |
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| Formula |
C19H18ClN3
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| Molecular Weight |
323.827
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| Canonical SMILES |
Clc1ccc(cc1)C1(CC1)c1nnc2c(cccn12)C1CCC1
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| InChI |
InChI=1S/C19H18ClN3/c20-15-8-6-14(7-9-15)19(10-11-19)18-22-21-17-16(13-3-1-4-13)5-2-12-23(17)18/h2,5-9,12-13H,1,3-4,10-11H2
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| InChIKey |
UTNGGQLDLOPGEY-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