General Information of the Compound
| Compound ID |
CP0022918
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| Compound Name |
N-[2-methoxy-5-(trifluoromethyl)phenyl]-2-(1-methylpyrazol-4-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine
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| Structure |
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| Formula |
C19H16F3N5O
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| Molecular Weight |
387.365
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| Canonical SMILES |
COc1ccc(cc1Nc1cc2[nH]c(cc2cn1)-c1cnn(C)c1)C(F)(F)F
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| InChI |
InChI=1S/C19H16F3N5O/c1-27-10-12(9-24-27)14-5-11-8-23-18(7-15(11)25-14)26-16-6-13(19(20,21)22)3-4-17(16)28-2/h3-10,25H,1-2H3,(H,23,26)
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| InChIKey |
WDWGMDGUGGLWHZ-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