General Information of the Compound
| Compound ID |
CP0426133
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| Compound Name |
[2-[(5-tert-butyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate
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| Structure |
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| Formula |
C21H20Cl2N4O3
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| Molecular Weight |
447.322
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| Canonical SMILES |
CC(C)(C)c1cc(NC(=O)COC(=O)c2cnc(Cl)c(Cl)c2)n(n1)-c1ccccc1
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| InChI |
InChI=1S/C21H20Cl2N4O3/c1-21(2,3)16-10-17(27(26-16)14-7-5-4-6-8-14)25-18(28)12-30-20(29)13-9-15(22)19(23)24-11-13/h4-11H,12H2,1-3H3,(H,25,28)
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| InChIKey |
NSVWWWFFKLWOOA-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