General Information of the Compound
| Compound ID |
CP0416634
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| Compound Name |
4-(3-(3-chlorophenylsulfonyl)thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-yl)morpholine
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| Structure |
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| Formula |
C17H14ClN5O3S2
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| Molecular Weight |
435.918
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| Canonical SMILES |
Clc1cccc(c1)S(=O)(=O)c1nnn2c3ccsc3c(nc12)N1CCOCC1
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| InChI |
InChI=1S/C17H14ClN5O3S2/c18-11-2-1-3-12(10-11)28(24,25)17-16-19-15(22-5-7-26-8-6-22)14-13(4-9-27-14)23(16)21-20-17/h1-4,9-10H,5-8H2
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| InChIKey |
IVYGCCAQEONGJR-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