General Information of the Compound
| Compound ID |
CP0353988
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| Compound Name |
2-[[3-[1-(4-chlorophenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]oxy]phenol
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| Structure |
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| Formula |
C21H16ClN3O2
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| Molecular Weight |
377.831
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| Canonical SMILES |
Oc1ccccc1Oc1cccn2c(nnc12)C1(CC1)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C21H16ClN3O2/c22-15-9-7-14(8-10-15)21(11-12-21)20-24-23-19-18(6-3-13-25(19)20)27-17-5-2-1-4-16(17)26/h1-10,13,26H,11-12H2
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| InChIKey |
MVSGEHDEGWQBQJ-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