General Information of the Compound
| Compound ID |
CP0475074
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| Compound Name |
2-cyclopentyl-4-[5-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide
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| Structure |
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| Formula |
C26H25N3O2
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| Molecular Weight |
411.505
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| Canonical SMILES |
COc1ccccc1-c1cnc2[nH]cc(-c3ccc(C(N)=O)c(c3)C3CCCC3)c2c1
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| InChI |
InChI=1S/C26H25N3O2/c1-31-24-9-5-4-8-19(24)18-13-22-23(15-29-26(22)28-14-18)17-10-11-20(25(27)30)21(12-17)16-6-2-3-7-16/h4-5,8-16H,2-3,6-7H2,1H3,(H2,27,30)(H,28,29)
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| InChIKey |
PEOMRLVZAVSRQW-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