General Information of the Compound
| Compound ID |
CP0212478
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| Compound Name |
[(1R)-1-phenylethyl] N-(2-methyl-4-phenylpyrazol-3-yl)carbamate
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| Structure |
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| Formula |
C19H19N3O2
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| Molecular Weight |
321.38
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| Canonical SMILES |
C[C@@H](OC(=O)Nc1c(cnn1C)-c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C19H19N3O2/c1-14(15-9-5-3-6-10-15)24-19(23)21-18-17(13-20-22(18)2)16-11-7-4-8-12-16/h3-14H,1-2H3,(H,21,23)/t14-/m1/s1
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| InChIKey |
QUWIZCMIURDWRW-CQSZACIVSA-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: PT03925, Lysophosphatidic acid receptor 1
Protein ID: PT02824, Lysophosphatidic acid receptor 3