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Murcko scaffold

Ring system with 4 rings and 21 atoms

21 chemicals on CompoundList share this ring system.

Rings: 4
Scaffold atoms: 21
Chemicals: 21
With full pages: 2

Scaffold SMILES

C1=C(N2CCNCC2)c2ccccc2Oc2ccccc21

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 C1=C(N2CCNCC2)c2ccccc2Oc2ccccc21

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 21 of 21 chemicals

2-Chloro-11-(4-methylpiperazino)dibenz[b,f]oxepin chemical structure, C19H19ClN2O, CAS 22013-22-5

2-Chloro-11-(4-methylpiperazino)dibenz[b,f]oxepin

CAS 22013-22-5C₁₉H₁₉ClN₂O

Metoxepin chemical structure, C20H22N2O2, CAS 22013-23-6

CAS 22013-23-6C₂₀H₂₂N₂O₂

Rmi 61,280 chemical structure, C19H19FN2O, CAS 57342-05-9

CAS 57342-05-9C₁₉H₁₉FN₂O

Piperazine, 1-dibenz(b,f)oxepin-10-yl-4-methyl- chemical structure, C19H20N2O, CAS 22012-06-2

Piperazine, 1-dibenz(b,f)oxepin-10-yl-4-methyl-

CAS 22012-06-2C₁₉H₂₀N₂O

Piperazine, 1-dibenz(b,f)oxepin-10-yl-4-ethyl- chemical structure, C20H22N2O, CAS 22012-07-3

Piperazine, 1-dibenz(b,f)oxepin-10-yl-4-ethyl-

CAS 22012-07-3C₂₀H₂₂N₂O

Piperazine, 1-dibenz(b,f)oxepin-10-yl-4-propyl- chemical structure, C21H24N2O, CAS 22012-08-4

Piperazine, 1-dibenz(b,f)oxepin-10-yl-4-propyl-

CAS 22012-08-4C₂₁H₂₄N₂O

Piperazine, 1-butyl-4-dibenz(b,f)oxepin-10-yl- chemical structure, C22H26N2O, CAS 22012-09-5

Piperazine, 1-butyl-4-dibenz(b,f)oxepin-10-yl-

CAS 22012-09-5C₂₂H₂₆N₂O

1-Piperazinecarboxylic acid, 4-dibenz(b,f)oxepin-10-yl-, ethyl ester chemical structure, C21H22N2O3, CAS 22012-10-8

1-Piperazinecarboxylic acid, 4-dibenz(b,f)oxepin-10-yl-, ethyl ester

CAS 22012-10-8C₂₁H₂₂N₂O₃

Piperazine, 1-(chlorodibenz(b,f)oxepin-10-yl)- chemical structure, C18H17ClN2O, CAS 56958-42-0

Piperazine, 1-(chlorodibenz(b,f)oxepin-10-yl)-

CAS 56958-42-0C₁₈H₁₇ClN₂O

Rmi 61683 chemical structure, C25H30FN3O2, CAS 56958-58-8

CAS 56958-58-8C₂₅H₃₀FN₃O₂

1-Piperazineacetamide, 4-(fluorodibenz(b,f)oxepin-10-yl)-alpha-methyl-N-propyl- chemical structure, C24H28FN3O2, CAS 56958-59-9

1-Piperazineacetamide, 4-(fluorodibenz(b,f)oxepin-10-yl)-alpha-methyl-N-propyl-

CAS 56958-59-9C₂₄H₂₈FN₃O₂

1-Piperazineacetamide, N-ethyl-4-(fluorodibenz(b,f)oxepin-10-yl)- chemical structure, C22H24FN3O2, CAS 56958-60-2

1-Piperazineacetamide, N-ethyl-4-(fluorodibenz(b,f)oxepin-10-yl)-

CAS 56958-60-2C₂₂H₂₄FN₃O₂

1-Piperazinecarboxylic acid, 4-(fluorodibenz(b,f)oxepin-10-yl)-, ethyl ester chemical structure, C21H21FN2O3, CAS 56958-61-3

1-Piperazinecarboxylic acid, 4-(fluorodibenz(b,f)oxepin-10-yl)-, ethyl ester

CAS 56958-61-3C₂₁H₂₁FN₂O₃

1-Piperazineacetamide, N,N-dimethyl-4-(fluorodibenz(b,f)oxepin-10-yl)- chemical structure, C22H24FN3O2, CAS 56958-62-4

1-Piperazineacetamide, N,N-dimethyl-4-(fluorodibenz(b,f)oxepin-10-yl)-

CAS 56958-62-4C₂₂H₂₄FN₃O₂

Piperazine, 1-(fluorodibenz(b,f)oxepin-10-yl)- chemical structure, C18H17FN2O, CAS 56958-65-7

Piperazine, 1-(fluorodibenz(b,f)oxepin-10-yl)-

CAS 56958-65-7C₁₈H₁₇FN₂O

Rmi 61392 chemical structure, C21H21ClN2O3, CAS 56958-66-8

CAS 56958-66-8C₂₁H₂₁ClN₂O₃

Piperazine, 1-(6-chlorodibenz(b,f)oxepin-10-yl)-4-methyl- chemical structure, C19H19ClN2O, CAS 56972-80-6

Piperazine, 1-(6-chlorodibenz(b,f)oxepin-10-yl)-4-methyl-

CAS 56972-80-6C₁₉H₁₉ClN₂O

Piperazine, 1-(6-chlorodibenz(b,f)oxepin-10-yl)- chemical structure, C18H17ClN2O, CAS 56972-81-7

Piperazine, 1-(6-chlorodibenz(b,f)oxepin-10-yl)-

CAS 56972-81-7C₁₈H₁₇ClN₂O

Rmi 61,140 chemical structure, C23H23ClN2O5, CAS 24140-98-5

CAS 24140-98-5C₂₃H₂₃ClN₂O₅

Piperazine, 1-(dibenz(b,f)oxepin-10-yl)-4-methyl-, maleate (1:1) chemical structure, C23H24N2O5, CAS 22431-61-4

Piperazine, 1-(dibenz(b,f)oxepin-10-yl)-4-methyl-, maleate (1:1)

CAS 22431-61-4C₂₃H₂₄N₂O₅

Metoxepin maleate chemical structure, C24H26N2O6, CAS 24141-01-3

Metoxepin maleate

CAS 24141-01-3C₂₄H₂₆N₂O₆