CodeDGW
Name(5S,7S)-7-{[4-(2,6-dichlorophenyl)piperidin-1-yl]methyl}-1-methyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-ol
Synonyms
Identifier(5S,7S)-7-[[4-[2,6-bis(chloranyl)phenyl]piperidin-1-yl]methyl]-1-methyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-ol
FormulaC24 H29 Cl2 N O
Molecular Weight418.399
SMILESCc1cccc2c1CC[C@@H](C[C@@H]2O)CN3CCC(CC3)c4c(cccc4Cl)Cl
PubChem10047612
Formal Charge0
Total Atoms57
Total Chiral Atoms2
Total Bonds60
Total Aromatic Bonds12
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
5DHH A Peptide Opioid NOP Homo sapiens SB-612111 - - 3 2015-10-21 10.1016/j.str.2015.07.024

A 2D representation of the interactions of DGW in 5DHH
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:L104 R:R:Y58 4.69 1 Yes Yes 7 7 2 2
R:R:Y309 R:R:Y58 4.96 1 Yes Yes 6 7 1 2
R:R:L104 R:R:Y309 11.72 1 Yes Yes 7 6 2 1
R:R:Q107 R:R:Y309 11.27 1 No Yes 5 6 1 1
L:L:?6 R:R:Q107 16.14 1 Yes No 0 5 0 1
R:R:D110 R:R:W116 6.7 0 No Yes 4 8 1 2
L:L:?6 R:R:D110 8.71 1 Yes No 0 4 0 1
R:R:C123 R:R:W116 5.22 1 No Yes 9 8 2 2
R:R:C200 R:R:W116 6.53 1 Yes Yes 9 8 1 2
R:R:C123 R:R:C200 7.28 1 No Yes 9 9 2 1
R:R:D130 R:R:Y309 4.6 1 No Yes 6 6 1 1
L:L:?6 R:R:D130 20.33 1 Yes No 0 6 0 1
R:R:V185 R:R:Y131 13.88 0 No No 4 4 2 1
R:R:V202 R:R:Y131 3.79 0 No No 4 4 2 1
L:L:?6 R:R:Y131 10.87 1 Yes No 0 4 0 1
R:R:M134 R:R:W276 10.47 1 No Yes 7 8 1 2
R:R:M134 R:R:Q280 4.08 1 No Yes 7 7 1 1
L:L:?6 R:R:M134 8.07 1 Yes No 0 7 0 1
L:L:?6 R:R:C200 4.53 1 Yes Yes 0 9 0 1
R:R:F220 R:R:Q280 7.03 0 No Yes 5 7 2 1
R:R:Q280 R:R:S223 5.78 1 Yes No 7 6 1 2
R:R:F224 R:R:Q280 23.42 0 Yes Yes 8 7 2 1
L:L:?6 R:R:Q280 12.34 1 Yes Yes 0 7 0 1
R:R:Q286 R:R:V283 4.3 0 No No 4 5 2 1
L:L:?6 R:R:V283 9.56 1 Yes No 0 5 0 1
R:R:T305 R:R:Y309 4.99 0 No Yes 5 6 2 1
L:L:?6 R:R:Y309 4.18 1 Yes Yes 0 6 0 1
R:R:C200 R:R:I127 3.27 1 Yes No 9 4 1 2
StatisticsValue
Average Number Of Links9.00
Average Number Of Links With An Hub3.00
Average Interaction Strength10.53
Average Nodes In Shell23.00
Average Hubs In Shell9.00
Average Links In Shell28.00
Average Links Mediated by Hubs In Shell25.00
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 Links9.00
Average Number Of Links With An Hub3.00
Average Interaction Strength10.53
Average Nodes In Shell23.00
Average Hubs In Shell9.00
Average Links In Shell28.00
Average Links Mediated by Hubs In Shell25.00

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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 🔍)