General Information of the Compound
| Compound ID |
CP0425459
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| Compound Name |
4-(4-chlorophenyl)-N-[6-(diethylaminomethyl)-7,8-dihydronaphthalen-2-yl]benzamide
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| Structure |
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| Formula |
C28H29ClN2O
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| Molecular Weight |
445.006
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| Canonical SMILES |
CCN(CC)CC1=Cc2ccc(NC(=O)c3ccc(cc3)-c3ccc(Cl)cc3)cc2CC1
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| InChI |
InChI=1S/C28H29ClN2O/c1-3-31(4-2)19-20-5-6-25-18-27(16-13-24(25)17-20)30-28(32)23-9-7-21(8-10-23)22-11-14-26(29)15-12-22/h7-18H,3-6,19H2,1-2H3,(H,30,32)
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| InChIKey |
RAERFBHNHNDJIP-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