Murcko scaffold

Ring system with 5 rings and 25 atoms

9 chemicals on CompoundList share this ring system.

Rings: 5
Scaffold atoms: 25
Chemicals: 9
With full pages: 1

Scaffold SMILES

c1ccc(C2Oc3ccccc3C3CC(c4cccnc4)=NN32)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(C2Oc3ccccc3C3CC(c4cccnc4)=NN32)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 9 of 9 chemicals

7-Ethoxy-5-(4-methoxyphenyl)-2-(pyridin-3-yl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine

CAS 853891-02-8C₂₄H₂₃N₃O₃

Methyl 4-(7-ethoxy-2-pyridin-3-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate

CAS 438575-63-4C₂₅H₂₃N₃O₄

5-(2-Chlorophenyl)-7-methoxy-2-pyridin-3-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine

CAS 450386-64-8C₂₂H₁₈ClN₃O₂

5-(3,4-Difluorophenyl)-7-methoxy-2-pyridin-3-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine

CAS 423130-65-8C₂₂H₁₇F₂N₃O₂

$7-(4-Chlorophenyl)-4-(pyridin-3-yl)-8-oxa-5,6-diazatricyclo[7.4.0.0^{2,6}]trideca-1(13),4,9,11-tetraene chemical structure, C21H16ClN3O, CAS 868155-33-3$

7-(4-Chlorophenyl)-4-(pyridin-3-yl)-8-oxa-5,6-diazatricyclo[7.4.0.0^{2,6}]trideca-1(13),4,9,11-tetraene

CAS 868155-33-3C₂₁H₁₆ClN₃O

$7-(3-Nitrophenyl)-4-(pyridin-3-yl)-8-oxa-5,6-diazatricyclo[7.4.0.0^{2,6}]trideca-1(13),4,9,11-tetraene chemical structure, C21H16N4O3, CAS 868155-37-7$