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Murcko scaffold

1,4,8,11-Tetraazabicyclo[6.6.2]hexadecane scaffold

14 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
16
Chemicals
14
With full pages
3
Scaffold SMILES

C1CNCCN2CCCNCCN(C1)CC2

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 scaffoldOpen the 1,4,8,11-Tetraazabicyclo[6.6.2]hexadecane page
Murcko scaffold C1CNCCN2CCCNCCN(C1)CC2

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 14 of 14 chemicals

4,11-Dimethyl-1,4,8,11-tetraazabicyclo[6.6.2]hexadecane chemical structure, C14H30N4, CAS 130434-62-7
4,11-Dimethyl-1,4,8,11-tetraazabicyclo[6.6.2]hexadecane
CAS 130434-62-7C14H30N4
1,4,8,11-Tetraazabicyclo[6.6.2]hexadecane chemical structure, C12H26N4, CAS 130701-19-8
1,4,8,11-Tetraazabicyclo[6.6.2]hexadecane
CAS 130701-19-8C12H26N4
2-[4-(Carboxymethyl)-1,4,8,11-tetrazabicyclo[6.6.2]hexadecan-11-yl]acetic acid chemical structure, C16H30N4O4, CAS 313229-90-2
2-[4-(Carboxymethyl)-1,4,8,11-tetrazabicyclo[6.6.2]hexadecan-11-yl]acetic acid
CAS 313229-90-2C16H30N4O4
4,11-Diethyl-1,4,8,11-tetraazabicyclo[6.6.2]hexadecane chemical structure, C16H34N4, CAS 272457-57-5
4,11-Diethyl-1,4,8,11-tetraazabicyclo[6.6.2]hexadecane
CAS 272457-57-5C16H34N4
5-N-Octyl-12-methyl-1,5,8,12-tetraazabicyclo[6.6.2]hexadecane chemical structure, C21H44N4, CAS 212697-55-7
5-N-Octyl-12-methyl-1,5,8,12-tetraazabicyclo[6.6.2]hexadecane
CAS 212697-55-7C21H44N4
CB-TE2A (tetrahydrochloride) chemical structure, C16H34Cl4N4O4, CAS 1260798-95-5
CB-TE2A (tetrahydrochloride)
CAS 1260798-95-5C16H34Cl4N4O4
Dichloro-5,12-diethyl-1,5,8,12-tetraazabicyclo[6.6.2]hexadecanemanganese chemical structure, C16H34Cl2MnN4, CAS 269729-99-9
Dichloro-5,12-diethyl-1,5,8,12-tetraazabicyclo[6.6.2]hexadecanemanganese
CAS 269729-99-9C16H34Cl2MnN4
Manganese, dichloro(4,11-dimethyl-1,4,8,11-tetraazabicyclo[6.6.2]hexadecane-I masculineN1,I masculineN4,I masculineN8,I masculineN11)-, (OC-6-22)- chemical structure, C14H30Cl2MnN4, CAS 212697-49-9
Manganese, dichloro(4,11-dimethyl-1,4,8,11-tetraazabicyclo[6.6.2]hexadecane-I masculineN1,I masculineN4,I masculineN8,I masculineN11)-, (OC-6-22)-
CAS 212697-49-9C14H30Cl2MnN4
(4R)-5-tert-Butoxy-4-[11-(2-tert-butoxy-2-oxo-ethyl)-1,4,8,11-tetrazabicyclo[6.6.2]hexadecan-4-yl]-5-oxo-pentanoic acid chemical structure, C27H50N4O6, CAS 1691256-18-4
(4R)-5-tert-Butoxy-4-[11-(2-tert-butoxy-2-oxo-ethyl)-1,4,8,11-tetrazabicyclo[6.6.2]hexadecan-4-yl]-5-oxo-pentanoic acid
CAS 1691256-18-4C27H50N4O6
5-tert-Butoxy-4-[11-(2-tert-butoxy-2-oxo-ethyl)-1,4,8,11-tetrazabicyclo[6.6.2]hexadecan-4-yl]-5-oxo-pentanoic acid chemical structure, C27H50N4O6, CAS 1044757-56-3
5-tert-Butoxy-4-[11-(2-tert-butoxy-2-oxo-ethyl)-1,4,8,11-tetrazabicyclo[6.6.2]hexadecan-4-yl]-5-oxo-pentanoic acid
CAS 1044757-56-3C27H50N4O6
5-tert-Butoxy-4-[11-(1-tert-butoxycarbonyl-3-carboxy-propyl)-1,4,8,11-tetrazabicyclo[6.6.2]hexadecan-4-yl]-5-oxo-pentanoic acid chemical structure, C30H54N4O8, CAS 1196861-31-0
5-tert-Butoxy-4-[11-(1-tert-butoxycarbonyl-3-carboxy-propyl)-1,4,8,11-tetrazabicyclo[6.6.2]hexadecan-4-yl]-5-oxo-pentanoic acid
CAS 1196861-31-0C30H54N4O8
(4S)-5-tert-Butoxy-4-[11-[(1R)-1-tert-butoxycarbonyl-3-carboxy-propyl]-1,4,8,11-tetrazabicyclo[6.6.2]hexadecan-4-yl]-5-oxo-pentanoic acid chemical structure, C30H54N4O8, CAS 1613159-85-5
(4S)-5-tert-Butoxy-4-[11-[(1R)-1-tert-butoxycarbonyl-3-carboxy-propyl]-1,4,8,11-tetrazabicyclo[6.6.2]hexadecan-4-yl]-5-oxo-pentanoic acid
CAS 1613159-85-5C30H54N4O8
(4S)-5-tert-Butoxy-4-[11-[(1S)-1-tert-butoxycarbonyl-3-carboxy-propyl]-1,4,8,11-tetrazabicyclo[6.6.2]hexadecan-4-yl]-5-oxo-pentanoic acid chemical structure, C30H54N4O8, CAS 1613159-80-0
(4S)-5-tert-Butoxy-4-[11-[(1S)-1-tert-butoxycarbonyl-3-carboxy-propyl]-1,4,8,11-tetrazabicyclo[6.6.2]hexadecan-4-yl]-5-oxo-pentanoic acid
CAS 1613159-80-0C30H54N4O8
(4R)-5-tert-Butoxy-4-[11-[(1R)-1-tert-butoxycarbonyl-3-carboxy-propyl]-1,4,8,11-tetrazabicyclo[6.6.2]hexadecan-4-yl]-5-oxo-pentanoic acid chemical structure, C30H54N4O8, CAS 1613159-79-7
(4R)-5-tert-Butoxy-4-[11-[(1R)-1-tert-butoxycarbonyl-3-carboxy-propyl]-1,4,8,11-tetrazabicyclo[6.6.2]hexadecan-4-yl]-5-oxo-pentanoic acid
CAS 1613159-79-7C30H54N4O8