General Information of the Compound
| Compound ID |
CP0499067
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| Compound Name |
4-(cyclopropylmethoxy)-N-[3-[1-(2-hydroxyethylamino)ethyl]-8-methylquinolin-7-yl]benzamide
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| Structure |
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| Formula |
C25H29N3O3
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| Molecular Weight |
419.525
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| Canonical SMILES |
CC(NCCO)c1cnc2c(C)c(NC(=O)c3ccc(OCC4CC4)cc3)ccc2c1
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| InChI |
InChI=1S/C25H29N3O3/c1-16-23(10-7-20-13-21(14-27-24(16)20)17(2)26-11-12-29)28-25(30)19-5-8-22(9-6-19)31-15-18-3-4-18/h5-10,13-14,17-18,26,29H,3-4,11-12,15H2,1-2H3,(H,28,30)
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| InChIKey |
LGVJSFVTVWXIFE-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: PT01388, Melanin-concentrating hormone receptor 1