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Murcko scaffold

Ring system with 4 rings and 19 atoms

13 chemicals on CompoundList share this ring system.

Rings: 4
Scaffold atoms: 19
Chemicals: 13
With full pages: 2

Scaffold SMILES

c1ccc(Cn2c3c(c4ccccc42)CCC3)cc1

A Bemis-Murcko scaffold is what remains of a molecule when every side chain is removed: the rings and the chains that link them. Chemicals that share a scaffold often belong to the same compound series, which helps when you look for analogues, alternative suppliers or related building blocks.

Substructure search with this scaffold

Murcko scaffold c1ccc(Cn2c3c(c4ccccc42)CCC3)cc1

Computed from the structures of the chemicals listed here. Stereo and charges are removed before the scaffold is taken.

Chemicals with this scaffold

Open one to see its structure, properties and suppliers.

Showing 1 to 13 of 13 chemicals

Laropiprant chemical structure, C21H19ClFNO4S, CAS 571170-77-9

CAS 571170-77-9C₂₁H₁₉ClFNO₄S

Diastereomer 2 chemical structure, C21H19ClFNO4S, CAS 571170-81-5

CAS 571170-81-5C₂₁H₁₉ClFNO₄S

(R)-2-(5-BroMo-4-(4-chlorobenzyl)-7-fluoro-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl)acetic acid chemical structure, C20H16BrClFNO2, CAS 393509-05-2

(R)-2-(5-BroMo-4-(4-chlorobenzyl)-7-fluoro-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl)acetic acid

CAS 393509-05-2C₂₀H₁₆BrClFNO₂

Laropiprant mixture with niacin chemical structure, C27H24ClFN2O6S, CAS 1046050-73-0

Laropiprant mixture with niacin

CAS 1046050-73-0C₂₇H₂₄ClFN₂O₆S

Cyclopent[b]indole-3-acetic acid, 4-[(4-chlorophenyl)methyl]-7-fluoro-1,2,3,4-tetrahydro-1-hydroxy-5-(methylsulfonyl)-, (1R,3R)- chemical structure, C21H19ClFNO5S, CAS 901779-03-1

Cyclopent[b]indole-3-acetic acid, 4-[(4-chlorophenyl)methyl]-7-fluoro-1,2,3,4-tetrahydro-1-hydroxy-5-(methylsulfonyl)-, (1R,3R)-

CAS 901779-03-1C₂₁H₁₉ClFNO₅S

[4-(4-Chlorobenzyl)-7-fluoro-5-bromo-1,2,3,4-tetrahydrocyclopenta[B]indol-3-yl]acetic acid chemical structure, C20H16BrClFNO2, CAS 393509-04-1

[4-(4-Chlorobenzyl)-7-fluoro-5-bromo-1,2,3,4-tetrahydrocyclopenta[B]indol-3-yl]acetic acid

CAS 393509-04-1C₂₀H₁₆BrClFNO₂

MK 0524 sodium salt chemical structure, C21H18ClFNNaO4S, CAS 572874-50-1

MK 0524 sodium salt

CAS 572874-50-1C₂₁H₁₈ClFNNaO₄S

Laropiprant-d4 chemical structure, C21H19ClFNO4S, CAS 1132664-22-2

CAS 1132664-22-2C₂₁H₁₉ClFNO₄S

Methyl 2-[(3R)-4-(4-chlorobenzyl)-7-fluoro-5-(methylsulfonyl)-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl]acetate chemical structure, C22H21ClFNO4S, CAS 571170-92-8

Methyl 2-[(3R)-4-(4-chlorobenzyl)-7-fluoro-5-(methylsulfonyl)-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl]acetate

CAS 571170-92-8C₂₂H₂₁ClFNO₄S

(R)-Triethyl (5-broMo-4-(4-chlorobenzyl)-7-fluoro-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl)methanetricarboxylate chemical structure, C28H28BrClFNO6, CAS 869194-43-4

(R)-Triethyl (5-broMo-4-(4-chlorobenzyl)-7-fluoro-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl)methanetricarboxylate

CAS 869194-43-4C₂₈H₂₈BrClFNO₆

2-(4-(4-Chlorobenzyl)-7-fluoro-5-sulfamoyl-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl)aceticacid chemical structure, C20H18ClFN2O4S, CAS 2043025-96-1

2-(4-(4-Chlorobenzyl)-7-fluoro-5-sulfamoyl-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl)aceticacid

CAS 2043025-96-1C₂₀H₁₈ClFN₂O₄S

2-[(3R)-4-[(4-Chlorophenyl)methyl]-7-fluoro-5-sulfamoyl-2,3-dihydro-1H-cyclopenta[b]indol-3-yl]acetic acid chemical structure, C20H18ClFN2O4S

2-[(3R)-4-[(4-Chlorophenyl)methyl]-7-fluoro-5-sulfamoyl-2,3-dihydro-1H-cyclopenta[b]indol-3-yl]acetic acid

C₂₀H₁₈ClFN₂O₄S

[5-Bromo-4-(2-bromo-6-chloro-benzyl)-7-fluoro-1,2,3,4-tetrahydro-cyclopenta[b]indol-3-yl]-acetic acid chemical structure, C20H15Br2ClFNO2, CAS 1567365-72-3

[5-Bromo-4-(2-bromo-6-chloro-benzyl)-7-fluoro-1,2,3,4-tetrahydro-cyclopenta[b]indol-3-yl]-acetic acid

CAS 1567365-72-3C₂₀H₁₅Br₂ClFNO₂