General Information of the Compound
| Compound ID |
CP0558665
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| Compound Name |
2-(2-pyridin-4-ylindol-1-yl)-N-(pyridin-2-ylmethyl)acetamide
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| Structure |
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| Formula |
C21H18N4O
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| Molecular Weight |
342.402
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| Canonical SMILES |
O=C(Cn1c(cc2ccccc12)-c1ccncc1)NCc1ccccn1
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| InChI |
InChI=1S/C21H18N4O/c26-21(24-14-18-6-3-4-10-23-18)15-25-19-7-2-1-5-17(19)13-20(25)16-8-11-22-12-9-16/h1-13H,14-15H2,(H,24,26)
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| InChIKey |
WZGCSCUTQNHMDL-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