General Information of the Compound
| Compound ID |
CP0430038
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| Compound Name |
N-[2-(diethylamino)ethyl]-2-methoxy-4-[[4-(trifluoromethyl)phenyl]carbamoylamino]benzamide
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| Structure |
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| Formula |
C22H27F3N4O3
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| Molecular Weight |
452.477
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| Canonical SMILES |
CCN(CC)CCNC(=O)c1ccc(NC(=O)Nc2ccc(cc2)C(F)(F)F)cc1OC
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| InChI |
InChI=1S/C22H27F3N4O3/c1-4-29(5-2)13-12-26-20(30)18-11-10-17(14-19(18)32-3)28-21(31)27-16-8-6-15(7-9-16)22(23,24)25/h6-11,14H,4-5,12-13H2,1-3H3,(H,26,30)(H2,27,28,31)
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| InChIKey |
MNDYYSFCBPGDHG-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: PT01027, Melanin-concentrating hormone receptor 1
Protein ID: PT02767, Melanin-concentrating hormone receptor 2