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Murcko scaffold

Ring system with 2 rings and 28 atoms

33 chemicals on CompoundList share this ring system.

Rings: 2
Scaffold atoms: 28
Chemicals: 33
With full pages: 4

Scaffold SMILES

C(=NC=NCCCCCCN=CN=CNc1ccccc1)Nc1ccccc1

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 C(=NC=NCCCCCCN=CN=CNc1ccccc1)Nc1ccccc1

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 33 of 33 chemicals

1,1'-Hexamethylenebis[5-(p-chlorophenyl)biguanide] diacetate chemical structure, C26H38Cl2N10O4, CAS 206986-79-0

1,1'-Hexamethylenebis[5-(p-chlorophenyl)biguanide] diacetate

CAS 206986-79-0C₂₆H₃₈Cl₂N₁₀O₄

Chlorhexidinedihydrochloride chemical structure, C22H32Cl4N10, CAS 2012598-75-1

Chlorhexidinedihydrochloride

CAS 2012598-75-1C₂₂H₃₂Cl₄N₁₀

Chlorhexidine chemical structure, C22H30Cl2N10, CAS 55-56-1

CAS 55-56-1C₂₂H₃₀Cl₂N₁₀

Chlorhexidine gluconate chemical structure, C34H54Cl2N10O14, CAS 18472-51-0

Chlorhexidine gluconate

CAS 18472-51-0C₃₄H₅₄Cl₂N₁₀O₁₄

Chlorhexidine acetate chemical structure, C26H38Cl2N10O4, CAS 56-95-1

Chlorhexidine acetate

CAS 56-95-1C₂₆H₃₈Cl₂N₁₀O₄

Biguanide, 1,1'-hexamethylenebis(5-(alpha,alpha,alpha-trifluoro-m-tolyl)-, dihydrochloride chemical structure, C24H32Cl2F6N10, CAS 42242-51-3

Biguanide, 1,1'-hexamethylenebis(5-(alpha,alpha,alpha-trifluoro-m-tolyl)-, dihydrochloride

CAS 42242-51-3C₂₄H₃₂Cl₂F₆N₁₀

Chlorhexidine hydrochloride chemical structure, C22H32Cl4N10, CAS 3697-42-5

Chlorhexidine hydrochloride

CAS 3697-42-5C₂₂H₃₂Cl₄N₁₀

Progaron chemical structure, C31H43Cl4N11O2, CAS 108532-15-6

CAS 108532-15-6C₃₁H₄₃Cl₄N₁₁O₂

2,4,11,13-Tetraazatetradecanediimidamide, N,N''-bis(4-chlorophenyl)-3,12-diimino-, dihydroiodide chemical structure, C22H32Cl2I2N10, CAS 72099-47-9

2,4,11,13-Tetraazatetradecanediimidamide, N,N''-bis(4-chlorophenyl)-3,12-diimino-, dihydroiodide

CAS 72099-47-9C₂₂H₃₂Cl₂I₂N₁₀

Lurgyl chemical structure, C56H87AlCl3N13O23, CAS 82432-17-5

CAS 82432-17-5C₅₆H₈₇AlCl₃N₁₃O₂₃

Veadent mouth rinse chemical structure, C54H68Cl3N11O18, CAS 101332-77-8

Veadent mouth rinse

CAS 101332-77-8C₅₄H₆₈Cl₃N₁₁O₁₈

Chlorhexidine gluconate mixture with lidocaine hydrochloride chemical structure, C48H77Cl3N12O15, CAS 8060-72-8

Chlorhexidine gluconate mixture with lidocaine hydrochloride

CAS 8060-72-8C₄₈H₇₇Cl₃N₁₂O₁₅

Despa-kowa chemical structure, C69H89Cl2N11O10, CAS 82824-05-3

CAS 82824-05-3C₆₉H₈₉Cl₂N₁₁O₁₀

Trisdine chemical structure, C44H70Cl2N12O22, CAS 123354-94-9

CAS 123354-94-9C₄₄H₇₀Cl₂N₁₂O₂₂

(1E)-2-[6-[[Amino-[(E)-[amino-(4-chloroanilino)methylidene]amino]methylidene]amino]hexyl]-1-[amino-(4-chloroanilino)methylidene]guanidine, (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid chemical structure, C28H42Cl2N10O7, CAS 1308292-96-7

(1E)-2-[6-[[Amino-[(E)-[amino-(4-chloroanilino)methylidene]amino]methylidene]amino]hexyl]-1-[amino-(4-chloroanilino)methylidene]guanidine, (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid

CAS 1308292-96-7C₂₈H₄₂Cl₂N₁₀O₇

Chlorhexidine phosphanilate chemical structure, C34H46Cl2N12O6P2, CAS 77146-42-0

Chlorhexidine phosphanilate

CAS 77146-42-0C₃₄H₄₆Cl₂N₁₂O₆P₂

2-Hydroxyethane-1-sulfonic acid--N,N''''-hexane-1,6-diylbis[N'-(4-chlorophenyl)triimidodicarbonic diamide] (2/1) chemical structure, C26H42Cl2N10O8S2, CAS 72099-66-2

2-Hydroxyethane-1-sulfonic acid--N,N''''-hexane-1,6-diylbis[N'-(4-chlorophenyl)triimidodicarbonic diamide] (2/1)

CAS 72099-66-2C₂₆H₄₂Cl₂N₁₀O₈S₂

(1E)-2-[6-[[Amino-[(E)-[amino(anilino)methylidene]amino]methylidene]amino]hexyl]-1-[amino-(4-chloroanilino)methylidene]guanidine chemical structure, C22H31ClN10

(1E)-2-[6-[[Amino-[(E)-[amino(anilino)methylidene]amino]methylidene]amino]hexyl]-1-[amino-(4-chloroanilino)methylidene]guanidine

C₂₂H₃₁ClN₁₀

Tubilicid chemical structure, C52H93Cl2FN13NaO16, CAS 77257-39-7

CAS 77257-39-7C₅₂H₉₃Cl₂FN₁₃NaO₁₆

Chlorhexidine acetate hydrate(1:2:x) chemical structure, C26H40Cl2N10O5

Chlorhexidine acetate hydrate(1:2:x)

C₂₆H₄₀Cl₂N₁₀O₅

Chlorhexidine gluconate, isopropyl alcohol chemical structure, C37H62Cl2N10O14, CAS 74194-72-2

Chlorhexidine gluconate, isopropyl alcohol

CAS 74194-72-2C₃₇H₆₂Cl₂N₁₀O₁₄

Chlorhexidine-d8 dihydrochloride chemical structure, C22H30Cl2N10, CAS 1246816-96-5

Chlorhexidine-d8 dihydrochloride

CAS 1246816-96-5C₂₂H₃₀Cl₂N₁₀

Chlorhexidine acetate hydrate(1:2:x) chemical structure, C26H40Cl2N10O5

Chlorhexidine acetate hydrate(1:2:x)

C₂₆H₄₀Cl₂N₁₀O₅

ChlorhexidineCitrate chemical structure, C28H38Cl2N10O7, CAS 39014-05-6

ChlorhexidineCitrate

CAS 39014-05-6C₂₈H₃₈Cl₂N₁₀O₇