General Information of the Compound
| Compound ID |
CP0396718
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| Compound Name |
N-[6-[(dimethylamino)methyl]-5,6,7,8-tetrahydronaphthalen-2-yl]-4-(4-methylphenyl)benzamide
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| Structure |
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| Formula |
C27H30N2O
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| Molecular Weight |
398.55
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| Canonical SMILES |
CN(C)CC1CCc2cc(NC(=O)c3ccc(cc3)-c3ccc(C)cc3)ccc2C1
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| InChI |
InChI=1S/C27H30N2O/c1-19-4-7-21(8-5-19)22-10-12-23(13-11-22)27(30)28-26-15-14-24-16-20(18-29(2)3)6-9-25(24)17-26/h4-5,7-8,10-15,17,20H,6,9,16,18H2,1-3H3,(H,28,30)
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| InChIKey |
LZYYQXOPZXIZAG-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