General Information of the Compound
| Compound ID |
CP0494585
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| Compound Name |
4-chloro-N-[(1S)-1-(4,5-diethyl-1,2,4-triazol-3-yl)ethyl]benzenesulfonamide
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| Structure |
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| Formula |
C14H19ClN4O2S
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| Molecular Weight |
342.852
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| Canonical SMILES |
CCc1nnc([C@H](C)NS(=O)(=O)c2ccc(Cl)cc2)n1CC
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| InChI |
InChI=1S/C14H19ClN4O2S/c1-4-13-16-17-14(19(13)5-2)10(3)18-22(20,21)12-8-6-11(15)7-9-12/h6-10,18H,4-5H2,1-3H3/t10-/m0/s1
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| InChIKey |
DCEHBSNHFUVPFD-JTQLQIEISA-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