General Information of the Compound
| Compound ID |
CP0380509
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| Compound Name |
5-[[4-[3-(hydroxymethyl)phenyl]phenyl]methyl]-N,N-dimethyltetrazole-2-carboxamide
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| Structure |
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| Formula |
C18H19N5O2
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| Molecular Weight |
337.383
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| Canonical SMILES |
CN(C)C(=O)n1nnc(Cc2ccc(cc2)-c2cccc(CO)c2)n1
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| InChI |
InChI=1S/C18H19N5O2/c1-22(2)18(25)23-20-17(19-21-23)11-13-6-8-15(9-7-13)16-5-3-4-14(10-16)12-24/h3-10,24H,11-12H2,1-2H3
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| InChIKey |
NIBVVJPNCVELTO-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: PT01782, Monoglyceride lipase
Protein ID: PT02148, Transient receptor potential cation channel subfamily A member 1
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1