General Information of the Compound
| Compound ID |
CP0522111
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| Compound Name |
3-(1-benzyl-1H-tetrazol-5-yl)-1-phenylpropan-1-one
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| Structure |
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| Formula |
C18H17N3O
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| Molecular Weight |
291.354
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| Canonical SMILES |
O=C(CCc1cnnn1Cc1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C18H17N3O/c22-18(16-9-5-2-6-10-16)12-11-17-13-19-20-21(17)14-15-7-3-1-4-8-15/h1-10,13H,11-12,14H2
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| InChIKey |
BYTAYTGBNAWVBE-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