General Information of the Compound
| Compound ID |
CP0528229
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| Compound Name |
N-(5-tert-butyl-2-phenylpyrazol-3-yl)-2-[1-(2-ethoxyphenyl)tetrazol-5-yl]sulfanylacetamide
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| Structure |
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| Formula |
C24H27N7O2S
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| Molecular Weight |
477.594
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| Canonical SMILES |
CCOc1ccccc1-n1nnnc1SCC(=O)Nc1cc(nn1-c1ccccc1)C(C)(C)C
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| InChI |
InChI=1S/C24H27N7O2S/c1-5-33-19-14-10-9-13-18(19)31-23(26-28-29-31)34-16-22(32)25-21-15-20(24(2,3)4)27-30(21)17-11-7-6-8-12-17/h6-15H,5,16H2,1-4H3,(H,25,32)
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| InChIKey |
BGUYPHQCUACHCL-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
Protein ID: PT01390, BDNF/NT-3 growth factors receptor
Protein ID: PT00934, High affinity nerve growth factor receptor