General Information of the Compound
| Compound ID |
CP0477058
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| Compound Name |
[6-[4-(4-fluorophenyl)-3,5-dimethylpyrazol-1-yl]pyridin-3-yl]methanamine
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| Structure |
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| Formula |
C17H17FN4
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| Molecular Weight |
296.349
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| Canonical SMILES |
Cc1nn(c(C)c1-c1ccc(F)cc1)-c1ccc(CN)cn1
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| InChI |
InChI=1S/C17H17FN4/c1-11-17(14-4-6-15(18)7-5-14)12(2)22(21-11)16-8-3-13(9-19)10-20-16/h3-8,10H,9,19H2,1-2H3
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| InChIKey |
POIKSTHXKNCWIR-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: PT06880, Acid-sensing ion channel 1
Protein ID: PT06843, Acid-sensing ion channel 2