CodeDLH
Name2-(4-chlorophenyl)-1-spiro[1,3-benzodioxole-2,4'-piperidine]-1'-yl-ethanone
Synonyms
Identifier2-(4-chlorophenyl)-1-spiro[1,3-benzodioxole-2,4'-piperidine]-1'-yl-ethanone
FormulaC19 H18 Cl N O3
Molecular Weight343.804
SMILESc1ccc2c(c1)OC3(O2)CCN(CC3)C(=O)Cc4ccc(cc4)Cl
PubChem132473038
Formal Charge0
Total Atoms42
Total Chiral Atoms0
Total Bonds45
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
6FKB A Sensory Opsins Rhodopsin Bos taurus - PubChem 132473038 - 3.03 2018-04-04 10.1073/pnas.1718084115

A 2D representation of the interactions of DLH in 6FKB
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:E122 R:R:L125 3.98 2 Yes Yes 6 7 1 1
R:R:C167 R:R:E122 10.64 2 No Yes 5 6 2 1
R:R:E122 R:R:H211 8.62 2 Yes Yes 6 6 1 2
R:R:E122 W:W:?10 5.9 2 Yes Yes 6 0 1 0
R:R:L125 R:R:W126 4.56 2 Yes Yes 7 5 1 2
R:R:L125 R:R:P215 6.57 2 Yes No 7 9 1 2
R:R:L125 W:W:?10 7.2 2 Yes Yes 7 0 1 0
R:R:H211 R:R:W126 9.52 2 Yes Yes 6 5 2 2
R:R:P215 R:R:W126 8.11 2 No Yes 9 5 2 2
R:R:C167 R:R:M207 4.86 2 No Yes 5 5 2 1
R:R:C167 R:R:H211 7.37 2 No Yes 5 6 2 2
R:R:I189 R:R:Y191 16.92 0 No No 4 6 2 1
R:R:F203 R:R:I189 5.02 2 Yes No 6 4 2 2
R:R:Y191 W:W:?10 12.19 0 No Yes 6 0 1 0
R:R:F203 R:R:M207 7.46 2 Yes Yes 6 5 2 1
R:R:H211 R:R:M207 6.57 2 Yes Yes 6 5 2 1
R:R:M207 W:W:?10 9.45 2 Yes Yes 5 0 1 0
R:R:F208 R:R:F212 7.5 0 No No 5 8 2 1
R:R:F212 R:R:W265 25.05 0 No Yes 8 8 1 2
R:R:F212 W:W:?10 9.04 0 No Yes 8 0 1 0
R:R:C264 W:W:?10 4.71 0 No Yes 8 0 1 0
R:R:P291 R:R:Y268 12.52 0 Yes No 6 6 2 1
R:R:A295 R:R:Y268 4 0 No No 8 6 2 1
R:R:Y268 W:W:?10 18.28 0 No Yes 6 0 1 0
R:R:A272 W:W:?10 3.51 0 No Yes 5 0 1 0
R:R:V204 W:W:?10 3.32 0 No Yes 4 0 1 0
StatisticsValue
Average Number Of Links9.00
Average Number Of Links With An Hub3.00
Average Interaction Strength8.18
Average Nodes In Shell20.00
Average Hubs In Shell9.00
Average Links In Shell26.00
Average Links Mediated by Hubs In Shell23.00
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 Strength8.18
Average Nodes In Shell20.00
Average Hubs In Shell9.00
Average Links In Shell26.00
Average Links Mediated by Hubs In Shell23.00

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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 🔍)