General Information of the Compound
| Compound ID |
CP0969255
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| Compound Name |
4-fluoro-7-methyl-N-((1R,3S)-3-(pyridin-4-yl)cyclohexyl)-1H-indole-2-carboxamide
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| Structure |
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| Formula |
C21H22FN3O
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| Molecular Weight |
351.425
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| Canonical SMILES |
Cc1ccc(F)c2cc(C(=O)N[C@@H]3CCC[C@H](c4ccncc4)C3)[nH]c12
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| InChI |
InChI=1S/C21H22FN3O/c1-13-5-6-18(22)17-12-19(25-20(13)17)21(26)24-16-4-2-3-15(11-16)14-7-9-23-10-8-14/h5-10,12,15-16,25H,2-4,11H2,1H3,(H,24,26)/t15-,16+/m0/s1
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| InChIKey |
RMQXMDCYTCZCGI-JKSUJKDBSA-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