Explore small molecules, screening libraries, and tool compounds for discovery research. Browse by target, pathway, or ligand family to quickly find inhibitors, agonists, and chemical probes, with searchable structure/CAS data and supporting documents (SDS/COA where available).
By Target / Pathway / Disease
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Ready-to-screen compound libraries and focused sets for hit discovery. Browse libraries by target class, pathway, scaffold, or application, and review size, format, and compound information to build screening panels.Customize Your Screening Library to choose compounds, format, and volume, and we’ll prepare a ready-to-use set for you.Customize Your Screening Library
Ligand families
24,642Navigate small molecules by ligand family or scaffold to build focused sets and explore structure–activity relationships. This category groups related chemotypes, helping you select analogs, fragments, and tool molecules for discovery research.
ADC-focused building blocks and tools to support antibody–drug conjugate research. Explore payloads, linkers, conjugation reagents, and related small-molecule components (where available) for designing and evaluating ADC constructs.
PROTAC
2,814PROTAC and targeted protein degradation tools for discovery research. Browse degrader-related ligands, linkers, and building blocks (where available) to assemble or screen PROTAC designs, with clear identifiers for efficient selection.
By Signaling Pathways
102,635Explore pathway-focused tool compounds to study and modulate key signaling cascades. Browse small molecules grouped by signaling pathway to support mechanism studies, phenotypic assays, and target validation, with clear identifiers for fast searching.
By Target (DTO)
19,700Find bioactive small molecules organized by protein target (DTO). Quickly locate tool compounds for specific targets and compare identifiers such as structure, CAS, and synonyms—plus supporting documents (where available)—to build screening and validation sets.
By Disease (DOID)
8,782Shop small molecules and tool compounds organized by disease area (DOID). Discover chemical probes, libraries, and related products mapped to therapeutic areas to help assemble compound sets for screening, pathway exploration, and model studies.
Popular Products
- 7-epi-CephalomannineCAS: 150547-36-7 Formula: C45H53NO14 Molecular Weight: 831.9◐ .Made to order · 8–12 wks Item #: E275519View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- show more
- SMILES
- CC=C(C)C(=O)NC(C1=CC=CC=C1)C(C(=O)OC2CC3(C(C4C(C(CC5C4(CO5)OC(=O)C)O)(C(=O)C(C(=C2C)C3(C)C)OC(=O)C)C)OC(=O)C6=CC=CC=C6)O)O
- InChIKey
- DBXFAPJCZABTDR-DBVZQHIHSA-N
- InChI
- show more
- Synonyms
- 7-Epicephalomannine | 7-epi-Cephalomannine | Benzenepropanoic acid, alpha-hydroxy-beta-[[(2E)-2-methyl-1-oxo-2-buten-...
- 7-hydroxy-1,2-dihydroquinolin-2-one● In Stock — US warehouse, ships to EU* Item #: H177239View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 7-hydroxy-1H-quinolin-2-one
- SMILES
- C1=CC(=CC2=C1C=CC(=O)N2)O
- InChIKey
- DBSPUDKBNOZFMX-UHFFFAOYSA-N
- InChI
- 1S/C9H7NO2/c11-7-3-1-6-2-4-9(12)10-8(6)5-7/h1-5,11H,(H,10,12)
- Synonyms
- 7-Hydroxy-2-quinolinone | s3936 | SCHEMBL252706 | 3B25C3NP9L | CHEBI:48987 | FD7357 | Q27121423 | A836903 | 7-HYDROXY...
- Sulfo-Cyanine7 carboxylic acid◐ .Made to order · 8–12 wks Item #: S276359View ProductPricing & Pack Sizes
Technical Identifiers
- 7BIO● In Stock — US warehouse, ships to EU* Item #: B338496View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 7-bromo-3-(3-nitroso-1H-indol-2-yl)-1H-indol-2-ol
- SMILES
- C1=CC=C2C(=C1)C(=C(N2)C3=C(NC4=C3C=CC=C4Br)O)N=O
- InChIKey
- HYMACPDEJIEMST-UHFFFAOYSA-N
- InChI
- 1S/C16H10BrN3O2/c17-10-6-3-5-9-12(16(21)19-13(9)10)15-14(20-22)8-4-1-2-7-11(8)18-15/h1-7,18-19,21H
- Synonyms
- 7-Bromoindirubin-3'-oxime | 7-bromo-3-[1,3-dihydro-3-(hydroxyimino)-2H-indol-2-ylidene]-1,3-dihydro-2H-indol-2-one
- 7H-Dodecafluoroheptanealdehyde hydrateCAS: 812-87-3(anhydrous) Formula: C7H4F12O2 Molecular Weight: 348.09（anhydrous）● In Stock — US warehouse, ships to EU* Item #: H338738View ProductPricing & Pack Sizes
Technical Identifiers
- Synonyms
- 7H-Perfluoroheptanal hydrate
- 7alpha,12alpha-Dihydroxy-5beta-cholestan-3-one◐ .Made to order · 8–12 wks Item #: A275865View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- show more
- SMILES
- CC(C)CCCC(C)C1CCC2C1(C(CC3C2C(CC4C3(CCC(=O)C4)C)O)O)C
- InChIKey
- HHVQPBXBALLUDF-QORHGLQKSA-N
- InChI
- show more
- Synonyms
- A-Dihydroxy-5 | Cholestan-3-one, 7,12-dihydroxy-, (5beta,7alpha,12alpha)- | 7alpha,12alpha-Dihydroxy-5beta-cholestan-...
- Surfen dihydrochloride● In Stock — US warehouse, ships to EU* Item #: S286940View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 1,3-bis(4-amino-2-methylquinolin-6-yl)urea;dihydrochloride
- SMILES
- CC1=CC(=C2C=C(C=CC2=N1)NC(=O)NC3=CC4=C(C=C(N=C4C=C3)C)N)N.Cl.Cl
- InChIKey
- GKQYGRWQCWWSHN-UHFFFAOYSA-N
- InChI
- show more
- Synonyms
- AKOS030527176 | EINECS 226-566-0 | Tox21_110013 | 1,3-Bis(4-amino-2-methyl-6-quinolyl)urea dihydrochloride | DTXSID10...
- 7-Nitroindole-2-carboxylic acidSolid ≥97%(HPLC)● In Stock — US warehouse, ships to EU* Item #: N124837View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 7-nitro-1H-indole-2-carboxylic acid
- SMILES
- C1=CC2=C(C(=C1)[N+](=O)[O-])NC(=C2)C(=O)O
- InChIKey
- BIUCOFQROHIAEO-UHFFFAOYSA-N
- InChI
- 1S/C9H6N2O4/c12-9(13)6-4-5-2-1-3-7(11(14)15)8(5)10-6/h1-4,10H,(H,12,13)
- Synonyms
- CRT0044876, >=98% (HPLC) | 7-Nitro-1H-indole-2-carboxylic acid | BDBM50030281 | 7-Nitroindole-2-carboxylic acid | CCG...
- Ethyl Lauroyl Arginate HydrochlorideCAS: 60372-77-2 EC Number: 434-630-6 PubChem CID: 25229630 Formula: C20H41ClN4O3 Molecular Weight: 421.02Solid ≥96%● In Stock — US warehouse, ships to EU* Item #: E304112View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- ethyl (2S)-5-(diaminomethylideneamino)-2-(dodecanoylamino)pentanoate;hydrochloride
- SMILES
- CCCCCCCCCCCC(=O)NC(CCCN=C(N)N)C(=O)OCC.Cl
- InChIKey
- CUBZMGWLVMQKNE-LMOVPXPDSA-N
- InChI
- 1S/C20H40N4O3.ClH/c1-3-5-6-7-8-9-10-11-12-15-18(25)24-17(19(26)27-4-2)14-13-16-23-20(21)22;/h17H,3-16H2,1-2H3,(H,24,25)(H4,21,22,23);1H/t17-;/m0./s1
- Synonyms
- CUBZMGWLVMQKNE-LMOVPXPDSA-N | Q27293951 | SCHEMBL1038333 | BS-17290 | N2-(1-Oxododecyl)-L-arginine Ethyl Ester Hydroc...
- 8-(4-Chlorophenylthio)adenosine 3′,5′-cyclic monophosphate sodium saltCAS: 93882-12-3 Formula: C16H14ClN5NaO6PS Molecular Weight: 493.79Solid ≥99%● In Stock — US warehouse, ships to EU* Item #: C276526View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- sodium;(4aR,6R,7R,7aS)-6-[6-amino-8-(4-chlorophenyl)sulfanylpurin-9-yl]-2-oxido-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol
- SMILES
- C1C2C(C(C(O2)N3C4=NC=NC(=C4N=C3SC5=CC=C(C=C5)Cl)N)O)OP(=O)(O1)[O-].[Na+]
- InChIKey
- YIJFVHMIFGLKQL-DNBRLMRSSA-M
- InChI
- show more
- Synonyms
- 8-Cpt-camp | 8-(4-Chlorophenylthio)-cAMP sodium | 8-(4-Chlorophenylthio)-adenosine-3',5'-cyclic monophosphate, sodium...
- 8,11,14-Eicosatrienoic AcidCAS: 7324-41-6 Formula: C20H34O2 Molecular Weight: 306.48◐ .Made to order · 8–12 wks Item #: E304507View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- (8E,11E,14E)-icosa-8,11,14-trienoic acid
- SMILES
- CCCCCC=CCC=CCC=CCCCCCCC(=O)O
- InChIKey
- HOBAELRKJCKHQD-YHTMAJSVSA-N
- InChI
- 1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13H,2-5,8,11,14-19H2,1H3,(H,21,22)/b7-6+,10-9+,13-12+
- Synonyms
- 8,11,14-Eicosatrienoic acid (VAN) | Dihomo-gamma-linolenic Acid (20:3, n-6) | cis-8?11?14-Eicosatrienoic Acid | AKOS0...
- Ethylene glycol monostearateSolid ≥99%● In Stock — Germany Item #: E302211View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 2-hydroxyethyl octadecanoate
- SMILES
- CCCCCCCCCCCCCCCCCC(=O)OCCO
- InChIKey
- RFVNOJDQRGSOEL-UHFFFAOYSA-N
- InChI
- 1S/C20H40O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(22)23-19-18-21/h21H,2-19H2,1H3
- Synonyms
- Emanon 3199 | Cerasynt MN | Lactine | MYS 40 | Nikkol MYS 4 | PEG 42 | Akyporox S 100 | Cerasynt M | Nonex 63 | PEG-4...
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Frequently Asked Questions
What does the By Target/Pathway/Disease listing cover?
It groups compounds associated with targets in By Target/Pathway/Disease, organised so you can move from the pathway to an individual target and then to a specific chemotype. Each entry carries structure, CAS number, and reported activity.
How is By Target/Pathway/Disease organised?
By Target/Pathway/Disease is broken down into Compound Libraries, PROTACs, molecular glues and other degraders and Antibody-drug Conjugates(ADC). Compounds acting on more than one node appear under each relevant target.
How do I choose compounds for By Target/Pathway/Disease research?
For By Target/Pathway/Disease, pick a well-characterised reference compound for the node you want to perturb, and pair it with a structurally unrelated compound hitting the same target — that is the cleanest way to separate pathway effects from off-target ones. Check potency, selectivity, and cell permeability against your assay format. All products are supplied for professional research and development use only, and are not for use in humans, animals, diagnostics, or therapy.
How do I find a specific compound within By Target/Pathway/Disease?
Search By Target/Pathway/Disease by compound name, CAS number, or SMILES, or drill down through the target listing. Unlisted compounds and bulk quantities: [email protected]. We supply verified businesses, research institutions, universities, and government agencies.