Murcko scaffold
Ring system with 5 rings and 25 atoms
5 chemicals on CompoundList share this ring system.
- Rings
- 5
- Scaffold atoms
- 25
- Chemicals
- 5
- With full pages
- 3
Scaffold SMILES
O=C(Nc1cc2c(s1)CCCC2)c1c[nH]c2nc3ccccc3nc12
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.
![Murcko scaffold O=C(Nc1cc2c(s1)CCCC2)c1c[nH]c2nc3ccccc3nc12](/scaffold/NUGOIHRCCZRMOZ-UHFFFAOYSA-N/structure.svg)
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 5 of 5 chemicals
![2-[[[2-Amino-1-(3-methoxypropyl)-3-pyrrolo[3,2-b]quinoxalinyl]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester chemical structure, C26H29N5O4S, CAS 370847-74-8](/s/KNRRWJMZMCKYOX-UHFFFAOYSA-N.svg)
2-[[[2-Amino-1-(3-methoxypropyl)-3-pyrrolo[3,2-b]quinoxalinyl]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester
CAS 370847-74-8C26H29N5O4S
![Methyl 2-{[(2-amino-1-hexyl-1H-pyrrolo[2,3-b]quinoxalin-3-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate chemical structure, C27H31N5O3S, CAS 371232-08-5](/s/NCXZDKGATSKZOD-UHFFFAOYSA-N.svg)
Methyl 2-{[(2-amino-1-hexyl-1H-pyrrolo[2,3-b]quinoxalin-3-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
CAS 371232-08-5C27H31N5O3S
![Methyl 2-[[2-amino-1-(3-methoxypropyl)pyrrolo[3,2-b]quinoxaline-3-carbonyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate chemical structure, C25H27N5O4S, CAS 371926-47-5](/s/JMSZNBMXPZPQEY-UHFFFAOYSA-N.svg)
Methyl 2-[[2-amino-1-(3-methoxypropyl)pyrrolo[3,2-b]quinoxaline-3-carbonyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
CAS 371926-47-5C25H27N5O4S
![Methyl 2-{[(2-amino-1-pentyl-1H-pyrrolo[2,3-b]quinoxalin-3-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate chemical structure, C26H29N5O3S, CAS 371117-61-2](/s/OCRCTDFICYWJJK-UHFFFAOYSA-N.svg)
Methyl 2-{[(2-amino-1-pentyl-1H-pyrrolo[2,3-b]quinoxalin-3-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
CAS 371117-61-2C26H29N5O3S
![Methyl 2-[[2-amino-1-(2-methoxyethyl)pyrrolo[3,2-b]quinoxaline-3-carbonyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate chemical structure, C24H25N5O4S, CAS 371138-20-4](/s/ORGDYQXPDUZFPU-UHFFFAOYSA-N.svg)
Methyl 2-[[2-amino-1-(2-methoxyethyl)pyrrolo[3,2-b]quinoxaline-3-carbonyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
CAS 371138-20-4C24H25N5O4S