Code8RI
Name(2E)-N-[(2S)-2-(dimethylamino)-3-(4-hydroxyphenyl)propyl]-3-(naphthalen-1-yl)prop-2-enamide
Synonyms
Identifier(~{E})-~{N}-[(2~{S})-2-(dimethylamino)-3-(4-hydroxyphenyl)propyl]-3-naphthalen-1-yl-prop-2-enamide
FormulaC24 H26 N2 O2
Molecular Weight374.475
SMILESCN(C)[C@@H](Cc1ccc(cc1)O)CNC(=O)/C=C/c2cccc3c2cccc3
PubChem162745306
Formal Charge0
Total Atoms54
Total Chiral Atoms1
Total Bonds56
Total Aromatic Bonds17
Networks1
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This ligand is also present in the following network:
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
7SCG A Peptide Opioid MOP Mus musculus FH210 - Gi1/Beta1/Gamma2 3 2022-04-20 10.1002/anie.202200269

A 2D representation of the interactions of 8RI in 7SCG
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)
Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
R:R:L121 R:R:Y326 3.52 0 Yes Yes 7 7 2 1
R:R:F123 R:R:W133 5.01 3 No Yes 6 8 2 2
R:R:F123 R:R:V143 2.62 3 No No 6 5 2 1
R:R:Q124 R:R:Y326 4.51 3 No Yes 6 7 1 1
L:L:?1 R:R:Q124 18.57 3 Yes No 0 6 0 1
R:R:N127 R:R:W133 3.39 0 No Yes 6 8 1 2
L:L:?1 R:R:N127 7.18 3 Yes No 0 6 0 1
R:R:C140 R:R:W133 3.92 3 No Yes 9 8 2 2
R:R:C217 R:R:W133 7.84 3 Yes Yes 9 8 1 2
R:R:C140 R:R:I144 3.27 3 No Yes 9 5 2 2
R:R:C140 R:R:C217 5.46 3 No Yes 9 9 2 1
L:L:?1 R:R:V143 2.6 3 Yes No 0 5 0 1
R:R:I144 R:R:V202 3.07 3 Yes No 5 5 2 2
R:R:C217 R:R:I144 3.27 3 Yes Yes 9 5 1 2
R:R:D147 R:R:Y326 4.6 3 No Yes 6 7 1 1
L:L:?1 R:R:D147 20.12 3 Yes No 0 6 0 1
R:R:V202 R:R:Y148 6.31 3 No No 5 4 2 1
L:L:?1 R:R:Y148 7.16 3 Yes No 0 4 0 1
R:R:F152 R:R:M151 6.22 0 Yes Yes 7 7 2 1
R:R:M151 R:R:W293 3.49 3 Yes Yes 7 8 1 2
R:R:H297 R:R:M151 2.63 3 Yes Yes 8 7 2 1
L:L:?1 R:R:M151 9.86 3 Yes Yes 0 7 0 1
R:R:F152 R:R:V236 5.24 0 Yes No 7 5 2 1
L:L:?1 R:R:C217 5.54 3 Yes Yes 0 9 0 1
R:R:L232 R:R:V236 2.98 0 No No 5 5 2 1
R:R:K233 R:R:V300 3.04 0 No No 4 5 2 1
L:L:?1 R:R:V236 9.09 3 Yes No 0 5 0 1
R:R:H297 R:R:W293 3.17 3 Yes Yes 8 8 2 2
R:R:H297 R:R:I296 2.65 3 Yes No 8 6 2 1
L:L:?1 R:R:I296 3.73 3 Yes No 0 6 0 1
R:R:V300 R:R:W318 2.45 0 No Yes 5 5 1 2
L:L:?1 R:R:V300 6.5 3 Yes No 0 5 0 1
L:L:?1 R:R:Y326 3.07 3 Yes Yes 0 7 0 1
R:R:T120 R:R:V143 1.59 0 No No 6 5 2 1
StatisticsValue
Average Number Of Links11.00
Average Number Of Links With An Hub3.00
Average Interaction Strength8.49
Average Nodes In Shell25.00
Average Hubs In Shell11.00
Average Links In Shell34.00
Average Links Mediated by Hubs In Shell29.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
StatisticsValue
Average Number Of Links11.00
Average Number Of Links With An Hub3.00
Average Interaction Strength8.49
Average Nodes In Shell25.00
Average Hubs In Shell11.00
Average Links In Shell34.00
Average Links Mediated by Hubs In Shell29.00

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Physico-chemical properties of the nodes interacting with this ligand

(Click to enlarge 🔍)

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Location of the nodes interacting with this ligand

(Click to enlarge 🔍)