Murcko scaffold
Isoxazoline scaffold
361 chemicals on CompoundList share this ring system.
- Rings
- 1
- Scaffold atoms
- 5
- Chemicals
- 361
- With full pages
- 64
Scaffold SMILES
C1=NOCC1
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. This is a very common single ring, so the list below is broad.
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 48 of 361 chemicals
5-Isoxazoleacetic acid, alpha-amino-3-chloro-4,5-dihydro-
CAS 52583-41-2C5H7ClN2O3
3-Nitro-4,5-dihydroisoxazole
CAS 1121-14-8C3H4N2O3
4,5-Dihydro-3-nitroisoxazole-2-oxide
CAS 4122-45-6C3H4N2O4
Hydroxy acivicin
CAS 54549-02-9C5H7ClN2O4
Isoxazole, 4,5-dihydro-3-methoxy-
CAS 40784-13-2C4H7NO2
1-(5-Tetradecyl-4,5-dihydro-1,2-oxazol-3-yl)pentadecan-1-one
CAS 65919-76-8C32H61NO2
Acivicin
CAS 42228-92-2C5H7ClN2O3
N-(3-Methoxy-4,5-dihydro-1,2-oxazol-4-yl)acetamide
CAS 14617-43-7C6H10N2O3
(R)-2-Amino-2-((R)-3-chloro-4,5-dihydroisoxazol-5-yl)acetic acid
CAS 76898-56-1C5H7ClN2O3
Methyl 7-(5-acetyl-4,5-dihydro-1,2-oxazol-3-yl)heptanoate
CAS 82781-81-5C13H21NO4
Methyl 5-methyl-4,5-dihydroisoxazole-5-carboxylate
CAS 87046-29-5C6H9NO3
4,5-Dihydro-1,2-oxazole-3-carboxylic acid
CAS 4485-98-7C4H5NO3
5-(Trifluoromethyl)-4,5-dihydro-1,2-oxazol-5-ol
CAS 134219-67-3C4H4F3NO2
5-Trichloromethyl-4,5-dihydro-5-isoxazolol
CAS 34648-11-8C4H4Cl3NO2
4-(2-Ethoxy-2-oxoethyl)-3,5-bis(ethoxycarbonyl)-4,5-dihydroisoxazole 2-oxide
CAS 362601-40-9C13H19NO8
3,5-Bis(ethoxycarbonyl)-4-(2-oxopropyl)-4,5-dihydroisoxazole 2-oxide
CAS 332898-58-5C12H17NO7
(3-tert-Butyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid
CAS 125674-52-4C7H14NO4P
Phosphonic acid, (4,5-dihydro-3-propyl-5-isoxazolyl)-, diammonium salt
CAS 125674-63-7C6H18N3O4P
Phosphinic acid, (3-(1,1-dimethylethyl)-4,5-dihydro-5-isoxazolyl)methyl-
CAS 125674-79-5C8H16NO3P
4-(2-Methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide
CAS 53183-90-7C10H13NO8
5-(tert-Butyl)-3-methyl-4,5-dihydroisoxazol-5-ol
CAS 53009-15-7C8H15NO2
3-Methyl-5-(trifluoromethyl)-4,5-dihydroisoxazol-5-ol
CAS 51479-84-6C5H6F3NO2
Ethyl 3-chloro-5-methyl-4,5-dihydro-1,2-oxazole-4-carboxylate
CAS 201138-38-7C7H10ClNO3
(3-Methyl-4,5-dihydro-1,2-oxazol-5-yl)methanamine
CAS 959311-13-8C5H10N2O
- (4S,5S)-5-Isopropyl-4-methyl-4,5-dihydroisoxazole-3-carbaldehyde131362-99-7C8H13NO2
- (E)-3-(Prop-1-en-1-yl)-4,5-dihydroisoxazole127812-26-4C6H9NO
- tert-Butyl 3-(5-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-4,5-dihydroisoxazole-3-carboxamido)butanoate902146-11-6C15H20F6N2O5
- Ethyl 4,5-dihydro-5-(2-hydroxybutyl)-3-isoxazolecarboxylate202817-14-9C10H17NO4
- 5-Isoxazolemethanol, 4,5-dihydro-3-methyl-I+/--[[(1-methylethyl)amino]methyl]-, (R*,S*)-175885-21-9C9H18N2O2
- Ethyl 5-(4-hydroxybutyl)-4,5-dihydro-1,2-oxazole-3-carboxylate185563-77-3C10H17NO4
- 2-(3-Methyl-4,5-dihydro-1,2-oxazol-5-yl)acetic acid193267-47-9C6H9NO3
- Methyl 3-isopropyl-4,5-dihydroisoxazole-5-carboxylate162218-92-0C8H13NO3
- Methyl 3-bromo-4,5-dihydroisoxazole-5-carboxylate127141-36-0C5H6BrNO3
- [(5R)-3-tert-Butyl-4,5-dihydro-1,2-oxazol-5-yl]methanol108169-80-8C8H15NO2
- 3-(5-Acetyl-4,5-dihydro-1,2-oxazol-3-yl)propanenitrile151373-32-9C8H10N2O2
- 3-Hexyl-4,5-dihydro-1,2-oxazole-5-carboxylic acid203392-16-9C10H17NO3
- 3,5-Diethyl 4,5-dihydro-3,5-isoxazoledicarboxylate40435-26-5C9H13NO5
- Methyl 3-formyl-4,5-dihydroisoxazole-5-carboxylate155526-79-7C6H7NO4
- (R)-5-((R)-2-Amino-2-carboxyethyl)-4,5-dihydroisoxazole-3-carboxylic acid824394-11-8C7H10N2O5
- 3-Isoxazolecarboxylic acid, 4,5-dihydro-5-(trimethylsilyl)-, ethyl ester139146-96-6C9H17NO3Si
- (4S,5R)-5-Isopropyl-4-methyl-4,5-dihydroisoxazole-3-carbaldehyde735317-46-1C8H13NO2
- 5-(1,1,1,3,3,3-Hexafluoro-2-hydroxypropan-2-yl)-4,5-dihydroisoxazole-3-carboxylic acid444342-51-2C7H5F6NO4
- Methyl 3-tert-butyl-4,5-dihydro-1,2-oxazole-5-carboxylate128709-25-1C9H15NO3
- 5-Isoxazolol, 4,5-dihydro-3-methyl-5-(trichloromethyl)-135351-22-3C5H6Cl3NO2
- 5-Isoxazolecarbonitrile, 4,5-dihydro-3-methyl-86260-83-5C5H6N2O
- Ethyl 5-cyano-4,5-dihydro-1,2-oxazole-3-carboxylate40499-67-0C7H8N2O3
- rel-(I+/-R,4R)-I+/--Amino-3-carboxy-4,5-dihydro-5,5-dimethyl-4-isoxazolepropanoic acid824394-17-4C9H14N2O5
- 3-Bromo-5,5-dimethyl-4,5-dihydro-1,2-oxazole882697-80-5C5H8BrNO