General Information of the Compound
| Compound ID |
CP0349724
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| Compound Name |
1-[5-[(4-phenylphenyl)methyl]tetrazol-1-yl]propan-2-one
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| Structure |
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| Formula |
C17H16N4O
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| Molecular Weight |
292.342
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| Canonical SMILES |
CC(=O)Cn1nnnc1Cc1ccc(cc1)-c1ccccc1
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| InChI |
InChI=1S/C17H16N4O/c1-13(22)12-21-17(18-19-20-21)11-14-7-9-16(10-8-14)15-5-3-2-4-6-15/h2-10H,11-12H2,1H3
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| InChIKey |
CMJCLKJQWKCDNI-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
Protein ID: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2
Protein ID: PT02148, Transient receptor potential cation channel subfamily A member 1
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1