General Information of the Compound
| Compound ID |
CP0109820
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| Compound Name |
(1S,2S)-2-[4-(3-methoxy-1-pyridin-2-ylindazol-6-yl)phenyl]cyclopropane-1-carboxylic acid
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| Structure |
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| Formula |
C23H19N3O3
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| Molecular Weight |
385.423
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| Canonical SMILES |
COc1nn(-c2ccccn2)c2cc(ccc12)-c1ccc(cc1)[C@H]1C[C@@H]1C(O)=O
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| InChI |
InChI=1S/C23H19N3O3/c1-29-22-17-10-9-16(12-20(17)26(25-22)21-4-2-3-11-24-21)14-5-7-15(8-6-14)18-13-19(18)23(27)28/h2-12,18-19H,13H2,1H3,(H,27,28)/t18-,19+/m1/s1
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| InChIKey |
BKBCOLUTTHSRPO-MOPGFXCFSA-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: PT04613, Free fatty acid receptor 1
Protein ID: PT03121, Free fatty acid receptor 4
Protein ID: PT04427, Free fatty acid receptor 4