General Information of the Compound
| Compound ID |
CP0528720
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| Compound Name |
5-cyclopropyl-6-(3-fluoro-2-methylpyridin-4-yl)-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine
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| Structure |
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| Formula |
C22H26FN5
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| Molecular Weight |
379.483
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| Canonical SMILES |
CN1CCC(CC1)Nc1n[nH]c2cc(c(cc12)C1CC1)-c1ccnc(C)c1F
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| InChI |
InChI=1S/C22H26FN5/c1-13-21(23)16(5-8-24-13)18-12-20-19(11-17(18)14-3-4-14)22(27-26-20)25-15-6-9-28(2)10-7-15/h5,8,11-12,14-15H,3-4,6-7,9-10H2,1-2H3,(H2,25,26,27)
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| InChIKey |
MKOKJJLUNMJTBK-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: PT02160, Toll-like receptor 7
Protein ID: PT02546, Toll-like receptor 8