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Murcko scaffold

Ring system with 4 rings and 25 atoms

20 chemicals on CompoundList share this ring system.

Rings: 4
Scaffold atoms: 25
Chemicals: 20
With full pages: 2

Scaffold SMILES

O=[PH](OCC1CCC(c2ccc3cncnn23)O1)Oc1ccccc1

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 O=[PH](OCC1CCC(c2ccc3cncnn23)O1)Oc1ccccc1

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 20 of 20 chemicals

Gs-6620 chemical structure, C29H37N6O9P, CAS 1350735-70-4

CAS 1350735-70-4C₂₉H₃₇N₆O₉P

N-[(S)-hydroxyphenoxyphosphinyl]-L-alanine,1-methylethyl ester, 6-ester with 2-C-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-2,5-anhydro-D-altrononitrile chemical structure, C24H29N6O8P

N-[(S)-hydroxyphenoxyphosphinyl]-L-alanine,1-methylethyl ester, 6-ester with 2-C-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-2,5-anhydro-D-altrononitrile

C₂₄H₂₉N₆O₈P

Cvd-0016508 chemical structure, C27H35N6O8P, CAS 1355050-11-1

CAS 1355050-11-1C₂₇H₃₅N₆O₈P

Propan-2-yl 2-[[[5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxyoxolan-2-yl]methoxy-phenoxyphosphoryl]amino]propanoate chemical structure, C24H29N6O8P

Propan-2-yl 2-[[[5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxyoxolan-2-yl]methoxy-phenoxyphosphoryl]amino]propanoate

C₂₄H₂₉N₆O₈P

(R)-Remdesivir chemical structure, C27H35N6O8P, CAS 1911578-75-0

CAS 1911578-75-0C₂₇H₃₅N₆O₈P

Remdesivir chemical structure, C27H35N6O8P, CAS 1809249-37-3

CAS 1809249-37-3C₂₇H₃₅N₆O₈P

Anti-virus agent 1 chemical structure, C24H29N6O8P, CAS 1911578-83-0

Anti-virus agent 1

CAS 1911578-83-0C₂₄H₂₉N₆O₈P

Remdesivir de(ethylbutyl 2-aminopropanoate) chemical structure, C18H18N5O7P, CAS 2607871-93-0

Remdesivir de(ethylbutyl 2-aminopropanoate)

CAS 2607871-93-0C₁₈H₁₈N₅O₇P

2-Ethylbutyl (2R)-2-[[[(2R,3S,4R,5R)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxyoxolan-2-yl]methoxy-phenoxyphosphoryl]amino]propanoate chemical structure, C27H35N6O8P, CAS 2093124-26-4

2-Ethylbutyl (2R)-2-[[[(2R,3S,4R,5R)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxyoxolan-2-yl]methoxy-phenoxyphosphoryl]amino]propanoate

CAS 2093124-26-4C₂₇H₃₅N₆O₈P

Remdesivir maleate chemical structure, C31H39N6O12P, CAS 2250110-53-1

Remdesivir maleate

CAS 2250110-53-1C₃₁H₃₉N₆O₁₂P

Remdesivir-D5 chemical structure, C27H35N6O8P, CAS 2440242-47-5

CAS 2440242-47-5C₂₇H₃₅N₆O₈P

Remdesivir-d4 chemical structure, C27H35N6O8P, CAS 2738376-82-2

CAS 2738376-82-2C₂₇H₃₅N₆O₈P

(?)-MMT5-14 chemical structure, C39H55N6O8P, CAS 2719679-31-7

CAS 2719679-31-7C₃₉H₅₅N₆O₈P

Remdesivir impurity 31 chemical structure, C27H35N6O8P

Remdesivir impurity 31

C₂₇H₃₅N₆O₈P

2-Ethylbutyl (2S)-2-[[[(2R,3S,4R,5R)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxyoxolan-2-yl]methoxy-phenoxyphosphoryl]amino]-2,3,3,3-tetradeuteriopropanoate chemical structure, C27H35N6O8P

2-Ethylbutyl (2S)-2-[[[(2R,3S,4R,5R)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxyoxolan-2-yl]methoxy-phenoxyphosphoryl]amino]-2,3,3,3-tetradeuteriopropanoate

C₂₇H₃₅N₆O₈P

2-Ethylbutyl (2S)-2-[[[(2R,3S,4R,5R)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxyoxolan-2-yl]methoxy-(2,3,4,5,6-pentadeuteriophenoxy)phosphoryl]amino]propanoate chemical structure, C27H35N6O8P

2-Ethylbutyl (2S)-2-[[[(2R,3S,4R,5R)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxyoxolan-2-yl]methoxy-(2,3,4,5,6-pentadeuteriophenoxy)phosphoryl]amino]propanoate

C₂₇H₃₅N₆O₈P

Remdesivir methylpropyl ester analog chemical structure, C25H31N6O8P, CAS 3047145-80-9

Remdesivir methylpropyl ester analog

CAS 3047145-80-9C₂₅H₃₁N₆O₈P

(S)-2-Ethylbutyl 2-(((S)-(((2R,3S,4R,5S)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-carbamoyl-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)(phenoxy)phosphoryl)amino)propanoate chemical structure, C27H37N6O9P, CAS 2768006-89-7

(S)-2-Ethylbutyl 2-(((S)-(((2R,3S,4R,5S)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-carbamoyl-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)(phenoxy)phosphoryl)amino)propanoate

CAS 2768006-89-7C₂₇H₃₇N₆O₉P

Remdesivir impurity 56 chemical structure, C27H35N6O8P, CAS 2096990-00-8

Remdesivir impurity 56

CAS 2096990-00-8C₂₇H₃₅N₆O₈P

Butyl ((((2R,3S,4R,5R)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)(phenoxy)phosphoryl)-L-alaninate chemical structure, C25H31N6O8P, CAS 2601424-37-5

Butyl ((((2R,3S,4R,5R)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)(phenoxy)phosphoryl)-L-alaninate

CAS 2601424-37-5C₂₅H₃₁N₆O₈P