General Information of the Compound
| Compound ID |
CP0380779
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| Compound Name |
N-methyl-N-(naphthalen-2-ylmethyl)-5-[(4-phenylphenyl)methyl]tetrazole-2-carboxamide
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| Structure |
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| Formula |
C27H23N5O
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| Molecular Weight |
433.515
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| Canonical SMILES |
CN(Cc1ccc2ccccc2c1)C(=O)n1nnc(Cc2ccc(cc2)-c2ccccc2)n1
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| InChI |
InChI=1S/C27H23N5O/c1-31(19-21-13-16-23-9-5-6-10-25(23)17-21)27(33)32-29-26(28-30-32)18-20-11-14-24(15-12-20)22-7-3-2-4-8-22/h2-17H,18-19H2,1H3
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| InChIKey |
UNKQTJPPVOTIGY-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