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Murcko scaffold

Ring system with 5 rings and 29 atoms

11 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
29
Chemicals
11
With full pages
3
Scaffold SMILES

c1cnc(NCc2cc3nc(-c4cccnc4)nc(N4CCOCC4)c3s2)nc1

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 c1cnc(NCc2cc3nc(-c4cccnc4)nc(N4CCOCC4)c3s2)nc1

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

Fimepinostat chemical structure, C23H24N8O4S, CAS 1339928-25-4
Fimepinostat
CAS 1339928-25-4C23H24N8O4S
Bebt-908 free base chemical structure, C23H25N9O3S, CAS 1235449-52-1
Bebt-908 free base
CAS 1235449-52-1C23H25N9O3S
Ethyl 2-[[2-[6-[2-(dimethylamino)ethoxy]-3-pyridinyl]-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]methyl-methylamino]pyrimidine-5-carboxylate chemical structure, C28H34N8O4S, CAS 1339926-67-8
Ethyl 2-[[2-[6-[2-(dimethylamino)ethoxy]-3-pyridinyl]-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]methyl-methylamino]pyrimidine-5-carboxylate
CAS 1339926-67-8C28H34N8O4S
Ethyl 2-[[2-[6-(dimethylamino)-3-pyridinyl]-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]methyl-methylamino]pyrimidine-5-carboxylate chemical structure, C26H30N8O3S, CAS 1235451-37-2
Ethyl 2-[[2-[6-(dimethylamino)-3-pyridinyl]-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]methyl-methylamino]pyrimidine-5-carboxylate
CAS 1235451-37-2C26H30N8O3S
Ethyl 2-[2-[2-(6-methoxy-3-pyridinyl)-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]propan-2-yl-methylamino]pyrimidine-5-carboxylate chemical structure, C27H31N7O4S, CAS 1339926-41-8
Ethyl 2-[2-[2-(6-methoxy-3-pyridinyl)-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]propan-2-yl-methylamino]pyrimidine-5-carboxylate
CAS 1339926-41-8C27H31N7O4S
Ethyl 2-[[2-[6-(2-hydroxyethoxy)-3-pyridinyl]-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]methyl-methylamino]pyrimidine-5-carboxylate chemical structure, C26H29N7O5S, CAS 1339926-62-3
Ethyl 2-[[2-[6-(2-hydroxyethoxy)-3-pyridinyl]-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]methyl-methylamino]pyrimidine-5-carboxylate
CAS 1339926-62-3C26H29N7O5S
Ethyl 2-[[2-(6-ethoxy-3-pyridinyl)-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]methyl-methylamino]pyrimidine-5-carboxylate chemical structure, C26H29N7O4S, CAS 1339926-55-4
Ethyl 2-[[2-(6-ethoxy-3-pyridinyl)-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]methyl-methylamino]pyrimidine-5-carboxylate
CAS 1339926-55-4C26H29N7O4S
Ethyl 2-[[2-(6-acetamido-3-pyridinyl)-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]methyl-methylamino]pyrimidine-5-carboxylate chemical structure, C26H28N8O4S, CAS 1235451-36-1
Ethyl 2-[[2-(6-acetamido-3-pyridinyl)-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]methyl-methylamino]pyrimidine-5-carboxylate
CAS 1235451-36-1C26H28N8O4S
Ethyl 2-[methyl-[1-[2-[6-(methylamino)-3-pyridinyl]-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]ethyl]amino]pyrimidine-5-carboxylate chemical structure, C26H30N8O3S, CAS 1339926-14-5
Ethyl 2-[methyl-[1-[2-[6-(methylamino)-3-pyridinyl]-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]ethyl]amino]pyrimidine-5-carboxylate
CAS 1339926-14-5C26H30N8O3S
CUDC-907 mesylate chemical structure, C24H28N8O7S2, CAS 1401998-36-4
CUDC-907 mesylate
CAS 1401998-36-4C24H28N8O7S2
Bebt-908 chemical structure, C23H28Cl3N9O3S, CAS 1646906-27-5
Bebt-908
CAS 1646906-27-5C23H28Cl3N9O3S