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Murcko scaffold

Ring system with 4 rings and 23 atoms

30 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
23
Chemicals
30
With full pages
5
Scaffold SMILES

c1ccc(CCNc2ncnc3c2ncn3C2CCCO2)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(CCNc2ncnc3c2ncn3C2CCCO2)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 30 of 30 chemicals

(R)-Pia chemical structure, C19H23N5O4, CAS 38594-96-6
(R)-Pia
CAS 38594-96-6C19H23N5O4
Phenylisopropyladenosine chemical structure, C19H23N5O4, CAS 29193-86-0
Phenylisopropyladenosine
CAS 29193-86-0C19H23N5O4
N(6)-2-(4-Amino-3-iodophenyl)ethyladenosine chemical structure, C18H21IN6O4, CAS 105834-00-2
N(6)-2-(4-Amino-3-iodophenyl)ethyladenosine
CAS 105834-00-2C18H21IN6O4
N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine chemical structure, C18H19IN8O4, CAS 105811-49-2
N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine
CAS 105811-49-2C18H19IN8O4
2-[6-[2-(3,4-Dihydroxyphenyl)ethylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol chemical structure, C18H21N5O6, CAS 54241-03-1
2-[6-[2-(3,4-Dihydroxyphenyl)ethylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CAS 54241-03-1C18H21N5O6
9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine chemical structure, C18H22N6O4, CAS 26775-35-9
9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine
CAS 26775-35-9C18H22N6O4
(S)-Pia chemical structure, C19H23N5O4, CAS 38594-97-7
(S)-Pia
CAS 38594-97-7C19H23N5O4
N(6)-(3-iodo-4-hydroxyphenyl)-1-isopropyladenosine chemical structure, C19H22IN5O5, CAS 92530-58-0
N(6)-(3-iodo-4-hydroxyphenyl)-1-isopropyladenosine
CAS 92530-58-0C19H22IN5O5
2-Azido-N(6)-4-hydroxyphenylisopropyladenosine chemical structure, C19H22N8O5, CAS 98897-11-1
2-Azido-N(6)-4-hydroxyphenylisopropyladenosine
CAS 98897-11-1C19H22N8O5
N6-(2-Phenylethyl)adenosine chemical structure, C18H21N5O4, CAS 20125-39-7
N6-(2-Phenylethyl)adenosine
CAS 20125-39-7C18H21N5O4
Apnea chemical structure, C18H22N6O4, CAS 89705-21-5
Apnea
CAS 89705-21-5C18H22N6O4
N6-(P-Hydroxyphenethyl)-adenosine) chemical structure, C18H21N5O5, CAS 41552-94-7
N6-(P-Hydroxyphenethyl)-adenosine)
CAS 41552-94-7C18H21N5O5
1'-C-Methyl-N-[(1R)-1-methyl-2-phenylethyl]-adenosine chemical structure, C20H25N5O4, CAS 406479-42-3
1'-C-Methyl-N-[(1R)-1-methyl-2-phenylethyl]-adenosine
CAS 406479-42-3C20H25N5O4
1'-C-Methyl-N-[(1S)-1-methyl-2-phenylethyl]-adenosine chemical structure, C20H25N5O4, CAS 406479-43-4
1'-C-Methyl-N-[(1S)-1-methyl-2-phenylethyl]-adenosine
CAS 406479-43-4C20H25N5O4
N-(2-Phenylethyl)adenosine 5'-(Tetrahydrogen Triphosphate) chemical structure, C18H24N5O13P3, CAS 181705-62-4
N-(2-Phenylethyl)adenosine 5'-(Tetrahydrogen Triphosphate)
CAS 181705-62-4C18H24N5O13P3
Adenosine 5'-(trihydrogen diphosphate), N-(2-phenylethyl)- chemical structure, C18H23N5O10P2, CAS 681175-76-8
Adenosine 5'-(trihydrogen diphosphate), N-(2-phenylethyl)-
CAS 681175-76-8C18H23N5O10P2
A-D-Ribofuranuronothioamide, 1-deoxy-N-ethyl-1-[6-[(1-methyl-2-phenylethyl)amino]-9H-purin-9-yl]-, (R)- chemical structure, C21H26N6O3S, CAS 120424-14-8
A-D-Ribofuranuronothioamide, 1-deoxy-N-ethyl-1-[6-[(1-methyl-2-phenylethyl)amino]-9H-purin-9-yl]-, (R)-
CAS 120424-14-8C21H26N6O3S
(2R,3S,4R,5R)-2-(Hydroxymethyl)-5-(6-(((S)-1-phenylbutan-2-yl)amino)-9H-purin-9-yl)tetrahydrofuran-3,4-diol chemical structure, C20H25N5O4, CAS 104687-83-4
(2R,3S,4R,5R)-2-(Hydroxymethyl)-5-(6-(((S)-1-phenylbutan-2-yl)amino)-9H-purin-9-yl)tetrahydrofuran-3,4-diol
CAS 104687-83-4C20H25N5O4
(2R,3R,4S,5R)-2-(6-(((S)-1-Hydroxy-3-phenylpropan-2-yl)amino)-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol chemical structure, C19H23N5O5, CAS 101164-88-9
(2R,3R,4S,5R)-2-(6-(((S)-1-Hydroxy-3-phenylpropan-2-yl)amino)-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
CAS 101164-88-9C19H23N5O5
2-(Hydroxymethyl)-5-[6-[(1-hydroxy-3-phenylpropan-2-yl)amino]purin-9-yl]oxolane-3,4-diol chemical structure, C19H23N5O5
2-(Hydroxymethyl)-5-[6-[(1-hydroxy-3-phenylpropan-2-yl)amino]purin-9-yl]oxolane-3,4-diol
C19H23N5O5
(2R,3S,4R,5S)-2-(Hydroxymethyl)-5-[6-[(1-hydroxy-3-phenylpropan-2-yl)amino]purin-9-yl]oxolane-3,4-diol chemical structure, C19H23N5O5
(2R,3S,4R,5S)-2-(Hydroxymethyl)-5-[6-[(1-hydroxy-3-phenylpropan-2-yl)amino]purin-9-yl]oxolane-3,4-diol
C19H23N5O5
(2R,3R,4S,5R)-2-(6-(((R)-1-Hydroxy-3-phenylpropan-2-yl)amino)-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol chemical structure, C19H23N5O5, CAS 110073-42-2
(2R,3R,4S,5R)-2-(6-(((R)-1-Hydroxy-3-phenylpropan-2-yl)amino)-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
CAS 110073-42-2C19H23N5O5
(2R,3R,4S,5R)-2-[6-[2-(4-Amino-3,5-diiodophenyl)ethylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol chemical structure, C18H20I2N6O4, CAS 105811-47-0
(2R,3R,4S,5R)-2-[6-[2-(4-Amino-3,5-diiodophenyl)ethylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CAS 105811-47-0C18H20I2N6O4
5'-Adenylic acid, N-[2-(4-aminophenyl)ethyl]- chemical structure, C18H23N6O7P, CAS 89705-22-6
5'-Adenylic acid, N-[2-(4-aminophenyl)ethyl]-
CAS 89705-22-6C18H23N6O7P