General Information of the Compound
| Compound ID |
CP0403484
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| Compound Name |
N-[6-[1-(3-chloro-4-cyanophenyl)-3,5-dimethylpyrazol-4-yl]oxypyridin-3-yl]acetamide
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| Structure |
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| Formula |
C19H16ClN5O2
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| Molecular Weight |
381.823
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| Canonical SMILES |
CC(=O)Nc1ccc(Oc2c(C)nn(c2C)-c2ccc(C#N)c(Cl)c2)nc1
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| InChI |
InChI=1S/C19H16ClN5O2/c1-11-19(27-18-7-5-15(10-22-18)23-13(3)26)12(2)25(24-11)16-6-4-14(9-21)17(20)8-16/h4-8,10H,1-3H3,(H,23,26)
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| InChIKey |
ASDXIYXXKOHKBW-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: PT00894, Androgen receptor