General Information of the Compound
| Compound ID |
CP0565781
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| Compound Name |
1-(4-chlorophenyl)-3-[(3R,4R)-4-(4-methoxyphenyl)-2-oxopyrrolidin-3-yl]urea
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| Structure |
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| Formula |
C18H18ClN3O3
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| Molecular Weight |
359.813
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| Canonical SMILES |
COc1ccc(cc1)[C@@H]1CNC(=O)[C@@H]1NC(=O)Nc1ccc(Cl)cc1
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| InChI |
InChI=1S/C18H18ClN3O3/c1-25-14-8-2-11(3-9-14)15-10-20-17(23)16(15)22-18(24)21-13-6-4-12(19)5-7-13/h2-9,15-16H,10H2,1H3,(H,20,23)(H2,21,22,24)/t15-,16+/m0/s1
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| InChIKey |
KHWQLQMKSMNUBQ-JKSUJKDBSA-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: PT02015, fMet-Leu-Phe receptor
Protein ID: PT02590, N-formyl peptide receptor 2