General Information of the Compound
| Compound ID |
CP0156199
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| Compound Name |
4-[7-[3-(cyclopentanecarbonylamino)propoxy]-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-6-yl]thiophene-2-carboxylic acid
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| Structure |
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| Formula |
C27H28N4O5S
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| Molecular Weight |
520.611
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| Canonical SMILES |
COc1ccc(cc1)-c1nc2ncc(-c3csc(c3)C(O)=O)c(OCCCNC(=O)C3CCCC3)c2[nH]1
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| InChI |
InChI=1S/C27H28N4O5S/c1-35-19-9-7-16(8-10-19)24-30-22-23(36-12-4-11-28-26(32)17-5-2-3-6-17)20(14-29-25(22)31-24)18-13-21(27(33)34)37-15-18/h7-10,13-15,17H,2-6,11-12H2,1H3,(H,28,32)(H,33,34)(H,29,30,31)
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| InChIKey |
DGFPVDWEMXBLRG-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