General Information of the Compound
| Compound ID |
CP0519997
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| Compound Name |
2-[3-(3-methyl-1-pyridin-2-ylindazol-6-yl)phenyl]acetic acid
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| Structure |
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| Formula |
C21H17N3O2
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| Molecular Weight |
343.386
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| Canonical SMILES |
Cc1nn(-c2ccccn2)c2cc(ccc12)-c1cccc(CC(O)=O)c1
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| InChI |
InChI=1S/C21H17N3O2/c1-14-18-9-8-17(16-6-4-5-15(11-16)12-21(25)26)13-19(18)24(23-14)20-7-2-3-10-22-20/h2-11,13H,12H2,1H3,(H,25,26)
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| InChIKey |
MSGBMLSJBAWNNR-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