General Information of the Compound
| Compound ID |
CP0053206
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| Compound Name |
4-[2-[[3-[1-(4-chlorophenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]oxy]phenyl]morpholine
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| Structure |
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| Formula |
C25H23ClN4O2
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| Molecular Weight |
446.938
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| Canonical SMILES |
Clc1ccc(cc1)C1(CC1)c1nnc2c(Oc3ccccc3N3CCOCC3)cccn12
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| InChI |
InChI=1S/C25H23ClN4O2/c26-19-9-7-18(8-10-19)25(11-12-25)24-28-27-23-22(6-3-13-30(23)24)32-21-5-2-1-4-20(21)29-14-16-31-17-15-29/h1-10,13H,11-12,14-17H2
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| InChIKey |
UUKVPGQBLMJINN-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