General Information of the Compound
| Compound ID |
CP0412964
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| Compound Name |
2-[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanyl-N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]acetamide
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| Structure |
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| Formula |
C20H19N7O2S
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| Molecular Weight |
421.486
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| Canonical SMILES |
Cc1cc(NC(=O)CSc2nnnn2-c2ccc(O)cc2)n(n1)-c1ccc(C)cc1
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| InChI |
InChI=1S/C20H19N7O2S/c1-13-3-5-15(6-4-13)26-18(11-14(2)23-26)21-19(29)12-30-20-22-24-25-27(20)16-7-9-17(28)10-8-16/h3-11,28H,12H2,1-2H3,(H,21,29)
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| InChIKey |
XSDRSAFHLFXPCT-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