General Information of the Compound
| Compound ID |
CP0169880
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| Compound Name |
6-[6-fluoro-2-methyl-1-(1-methylpyrazol-3-yl)indol-3-yl]sulfanylpyridine-2-carboxylic acid
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| Structure |
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| Formula |
C19H15FN4O2S
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| Molecular Weight |
382.42
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| Canonical SMILES |
Cc1c(Sc2cccc(n2)C(O)=O)c2ccc(F)cc2n1-c1ccn(C)n1
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| InChI |
InChI=1S/C19H15FN4O2S/c1-11-18(27-17-5-3-4-14(21-17)19(25)26)13-7-6-12(20)10-15(13)24(11)16-8-9-23(2)22-16/h3-10H,1-2H3,(H,25,26)
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| InChIKey |
UYXWERLZBLCHOG-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