General Information of the Compound
| Compound ID |
CP0016637
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| Compound Name |
N-benzyl-5-(1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3,4-oxadiazol-2-amine
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| Structure |
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| Formula |
C16H13N5O
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| Molecular Weight |
291.314
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| Canonical SMILES |
C(Nc1nnc(o1)-c1c[nH]c2ncccc12)c1ccccc1
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| InChI |
InChI=1S/C16H13N5O/c1-2-5-11(6-3-1)9-19-16-21-20-15(22-16)13-10-18-14-12(13)7-4-8-17-14/h1-8,10H,9H2,(H,17,18)(H,19,21)
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| InChIKey |
YXGFHFBKXWLFAZ-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