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Murcko scaffold

Ring system with 4 rings and 28 atoms

13 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
28
Chemicals
13
With full pages
3
Scaffold SMILES

O=C(c1ccccc1)C1CCN(CCn2c(=O)[nH]c3ccccc3c2=O)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 O=C(c1ccccc1)C1CCN(CCn2c(=O)[nH]c3ccccc3c2=O)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

Ketanserin chemical structure, C22H22FN3O3, CAS 74050-98-9
Ketanserin
CAS 74050-98-9C22H22FN3O3
6-Hydroxyketanserin chemical structure, C22H22FN3O4, CAS 94840-70-7
6-Hydroxyketanserin
CAS 94840-70-7C22H22FN3O4
7-Azidoketanserin chemical structure, C22H21FN6O3, CAS 95653-71-7
7-Azidoketanserin
CAS 95653-71-7C22H21FN6O3
6-Azidoketanserin chemical structure, C22H21FN6O3, CAS 97930-92-2
6-Azidoketanserin
CAS 97930-92-2C22H21FN6O3
Azidoiodoketanserin chemical structure, C22H20FIN6O3, CAS 136769-36-3
Azidoiodoketanserin
CAS 136769-36-3C22H20FIN6O3
7-Amino-8-iodoketanserin chemical structure, C22H22FIN4O3, CAS 105554-25-4
7-Amino-8-iodoketanserin
CAS 105554-25-4C22H22FIN4O3
N-2-Fluoroethylketanserin chemical structure, C24H25F2N3O3, CAS 136346-26-4
N-2-Fluoroethylketanserin
CAS 136346-26-4C24H25F2N3O3
7-Aminoketanserin chemical structure, C22H23FN4O3, CAS 102745-99-3
7-Aminoketanserin
CAS 102745-99-3C22H23FN4O3
N-Methylketanserin chemical structure, C23H24FN3O3, CAS 76315-77-0
N-Methylketanserin
CAS 76315-77-0C23H24FN3O3
11c-N-Methylketanserin chemical structure, C23H24FN3O3, CAS 99293-04-6
11c-N-Methylketanserin
CAS 99293-04-6C23H24FN3O3
Ketanserin tartrate chemical structure, C26H28FN3O9, CAS 83846-83-7
Ketanserin tartrate
CAS 83846-83-7C26H28FN3O9
3H-Ketanserin chemical structure, C22H22FN3O3, CAS 112307-74-1
3H-Ketanserin
CAS 112307-74-1C22H22FN3O3
R-41468 (+)-Tartrate salt chemical structure, C26H28FN3O9, CAS 121322-28-9
R-41468 (+)-Tartrate salt
CAS 121322-28-9C26H28FN3O9