General Information of the Compound
| Compound ID |
CP0074481
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| Compound Name |
4-[2-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]benzamide
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| Structure |
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| Formula |
C21H17N3O2
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| Molecular Weight |
343.386
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| Canonical SMILES |
COc1ccccc1-c1cc2c(ccnc2[nH]1)-c1ccc(cc1)C(N)=O
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| InChI |
InChI=1S/C21H17N3O2/c1-26-19-5-3-2-4-16(19)18-12-17-15(10-11-23-21(17)24-18)13-6-8-14(9-7-13)20(22)25/h2-12H,1H3,(H2,22,25)(H,23,24)
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| InChIKey |
SFFKUECRLQXXTN-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