General Information of the Compound
| Compound ID |
CP0472692
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| Compound Name |
4-phenyl-N-[6-(pyrrolidin-1-ylmethyl)-7,8-dihydronaphthalen-2-yl]benzamide
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| Structure |
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| Formula |
C28H28N2O
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| Molecular Weight |
408.545
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| Canonical SMILES |
O=C(Nc1ccc2C=C(CN3CCCC3)CCc2c1)c1ccc(cc1)-c1ccccc1
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| InChI |
InChI=1S/C28H28N2O/c31-28(24-12-10-23(11-13-24)22-6-2-1-3-7-22)29-27-15-14-25-18-21(8-9-26(25)19-27)20-30-16-4-5-17-30/h1-3,6-7,10-15,18-19H,4-5,8-9,16-17,20H2,(H,29,31)
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| InChIKey |
QQNJJXBJUFOPQJ-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