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Murcko scaffold

Ring system with 4 rings and 28 atoms

11 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
28
Chemicals
11
With full pages
2
Scaffold SMILES

O=C(c1ccccc1)N1CCN(c2cccc(NCc3cccnc3)c2)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)N1CCN(c2cccc(NCc3cccnc3)c2)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 11 of 11 chemicals

(3-Bromophenyl)-[4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]methanone chemical structure, C23H22BrN5O3, CAS 509113-95-5
(3-Bromophenyl)-[4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]methanone
CAS 509113-95-5C23H22BrN5O3
(2-Methylphenyl)-[4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]methanone chemical structure, C24H25N5O3, CAS 524033-92-9
(2-Methylphenyl)-[4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]methanone
CAS 524033-92-9C24H25N5O3
(3-Fluorophenyl)-[4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]methanone chemical structure, C23H22FN5O3, CAS 524034-97-7
(3-Fluorophenyl)-[4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]methanone
CAS 524034-97-7C23H22FN5O3
(3-Methylphenyl)-[4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]methanone chemical structure, C24H25N5O3, CAS 524034-80-8
(3-Methylphenyl)-[4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]methanone
CAS 524034-80-8C24H25N5O3
(3-Chlorophenyl)-[4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]methanone chemical structure, C23H22ClN5O3, CAS 524034-55-7
(3-Chlorophenyl)-[4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]methanone
CAS 524034-55-7C23H22ClN5O3
(2-Bromophenyl)-[4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]methanone chemical structure, C23H22BrN5O3, CAS 642430-16-8
(2-Bromophenyl)-[4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]methanone
CAS 642430-16-8C23H22BrN5O3
(3,4-Dichlorophenyl)-[4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]methanone chemical structure, C23H21Cl2N5O3, CAS 591736-72-0
(3,4-Dichlorophenyl)-[4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]methanone
CAS 591736-72-0C23H21Cl2N5O3
(4-tert-Butylphenyl)-[4-[4-nitro-3-(3-pyridinylmethylamino)phenyl]-1-piperazinyl]methanone chemical structure, C27H31N5O3, CAS 591726-85-1
(4-tert-Butylphenyl)-[4-[4-nitro-3-(3-pyridinylmethylamino)phenyl]-1-piperazinyl]methanone
CAS 591726-85-1C27H31N5O3
(2-Chlorophenyl)-[4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]methanone chemical structure, C23H22ClN5O3, CAS 642430-14-6
(2-Chlorophenyl)-[4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]methanone
CAS 642430-14-6C23H22ClN5O3
[4-[4-Nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]-phenylmethanone chemical structure, C23H23N5O3, CAS 592466-69-8
[4-[4-Nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]-phenylmethanone
CAS 592466-69-8C23H23N5O3
[4-[4-Nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]-(4-propan-2-ylphenyl)methanone chemical structure, C26H29N5O3, CAS 593238-05-2
[4-[4-Nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]-(4-propan-2-ylphenyl)methanone
CAS 593238-05-2C26H29N5O3