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).
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Ligand families
24,635Navigate 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
102,621Explore 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)
19,694Find 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 —to build screening and validation sets.
By Disease (DOID)
8,779Shop 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.
Products
- 7-CyanoindolineSolid ≥95%● In Stock — US warehouse, ships to EU* Item #: C331766View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 2,3-dihydro-1H-indole-7-carbonitrile
- SMILES
- C1CNC2=C1C=CC=C2C#N
- InChIKey
- YABRSQUYXZGQBW-UHFFFAOYSA-N
- InChI
- 1S/C9H8N2/c10-6-8-3-1-2-7-4-5-11-9(7)8/h1-3,11H,4-5H2
- Synonyms
- A847957 | FT-0685905 | 7-indolinecarbonitrile | 2,3-Dihydro-1H-indol-7-carbonitrile;7-Cyano-1H-indoline;2,3-Dihydro-1...
- 7-Ethoxybenzo[b]furan-2-carboxylic acidCAS: 206559-61-7 Formula: C11H10O4 Molecular Weight: 206.19◐ .Made to order · 8–12 wks Item #: E336756View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 7-ethoxy-1-benzofuran-2-carboxylic acid
- SMILES
- CCOC1=CC=CC2=C1OC(=C2)C(=O)O
- InChIKey
- DQJVZIUEXPTEKX-UHFFFAOYSA-N
- InChI
- 1S/C11H10O4/c1-2-14-8-5-3-4-7-6-9(11(12)13)15-10(7)8/h3-6H,2H2,1H3,(H,12,13)
- Synonyms
- DQJVZIUEXPTEKX-UHFFFAOYSA-N | EN300-265728 | MFCD00060710 | 7-ethoxybenzo[b]furan-2-carboxylic acid | 2-Benzofurancar...
- 7-Fluoro-2,3,4,5-tetrahydro-1H-benzo[e][1,4]diazepineCAS: 886366-21-8 Formula: C9H11FN2 Molecular Weight: 166.199● In Stock — US warehouse, ships to EU* Item #: F335988View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 7-fluoro-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine
- SMILES
- C1CNC2=C(CN1)C=C(C=C2)F
- InChIKey
- NNXGSKKLUSOLHT-UHFFFAOYSA-N
- InChI
- 1S/C9H11FN2/c10-8-1-2-9-7(5-8)6-11-3-4-12-9/h1-2,5,11-12H,3-4,6H2
- Synonyms
- Q-102434 | MFCD07369955 | AS-37738 | 7-Fluoro-2,3,4,5-tetrahydro-1H-benzo[e][1,4]diazepine | DTXSID30649668 | FT-0770...
- 7-EthylcamptothecinCAS: 78287-27-1 Formula: C22H20N2O4 Molecular Weight: 376.4110mM in DMSO● In Stock — US warehouse, ships to EU* Item #: E425943View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- (19S)-10,19-diethyl-19-hydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione
- SMILES
- CCC1=C2CN3C(=CC4=C(C3=O)COC(=O)C4(CC)O)C2=NC5=CC=CC=C51
- InChIKey
- MYQKIWCVEPUPIL-QFIPXVFZSA-N
- InChI
- 1S/C22H20N2O4/c1-3-12-13-7-5-6-8-17(13)23-19-14(12)10-24-18(19)9-16-15(20(24)25)11-28-21(26)22(16,27)4-2/h5-9,27H,3-4,10-11H2,1-2H3/t22-/m0/s1
- Synonyms
- 3,3,5-Trimethylcyclohexyl hydroxy(phenyl)acetate | 7-ETHYLCAMPTOTHECIN [USP IMPURITY] | Proeptatriene [Italian] | 4,1...
- 7-Fluoro-3,4-dihydro-1H-naphthalen-2-oneCAS: 29419-15-6 Formula: C10H9FO Molecular Weight: 164.179● In Stock — US warehouse, ships to EU* Item #: F338110View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 7-fluoro-3,4-dihydro-1H-naphthalen-2-one
- SMILES
- C1CC2=C(CC1=O)C=C(C=C2)F
- InChIKey
- NQMQVBHBOBSOSZ-UHFFFAOYSA-N
- InChI
- 1S/C10H9FO/c11-9-3-1-7-2-4-10(12)6-8(7)5-9/h1,3,5H,2,4,6H2
- Synonyms
- EN300-1699560 | NQMQVBHBOBSOSZ-UHFFFAOYSA-N | AS-30718 | FT-0647591 | NQMQVBHBOBSOSZ-UHFFFAOYSA- | 2(1H)-Naphthalenon...
- 7-Hydroxy-3,4-dihydro-2H-isoquinolin-1-oneCAS: 22246-05-5 Formula: C9H9NO2 Molecular Weight: 163.18● In Stock — US warehouse, ships to EU* Item #: H334772View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 7-hydroxy-3,4-dihydro-2H-isoquinolin-1-one
- SMILES
- C1CNC(=O)C2=C1C=CC(=C2)O
- InChIKey
- CZORCICKCUXXCZ-UHFFFAOYSA-N
- InChI
- 1S/C9H9NO2/c11-7-2-1-6-3-4-10-9(12)8(6)5-7/h1-2,5,11H,3-4H2,(H,10,12)
- Synonyms
- 3,4-Dihydro-7-hydroxy-1(2H)-isoquinolinone | DTXSID70657883 | BDBM50126169 | MFCD04114872 | AM20120497 | DS-13269 | S...
- Benzo[a]Pyren-7-OlCAS: 37994-82-4 Formula: C20H12O Molecular Weight: 268.31Solid ≥95%◐ .Made to order · 8–12 wks Item #: H333391View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- benzo[a]pyren-7-ol
- SMILES
- C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4C=CC=C5O)C=C2
- InChIKey
- CNQAYISXCZTDQX-UHFFFAOYSA-N
- InChI
- 1S/C20H12O/c21-18-6-2-5-15-16-10-9-13-4-1-3-12-7-8-14(11-17(15)18)20(16)19(12)13/h1-11,21H
- Synonyms
- 7-Hydroxybenzo[a]pyrene | 7-Hydroxybenzopyrene
- 7-Hydroxy Myristic AcidCAS: 70393-63-4 Formula: C14H28O3 Molecular Weight: 244.37● In Stock — US warehouse, ships to EU* Item #: H333760View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 7-hydroxytetradecanoic acid
- SMILES
- CCCCCCCC(CCCCCC(=O)O)O
- InChIKey
- LXFWNUZFODRHJO-UHFFFAOYSA-N
- InChI
- 1S/C14H28O3/c1-2-3-4-5-7-10-13(15)11-8-6-9-12-14(16)17/h13,15H,2-12H2,1H3,(H,16,17)
- Synonyms
- 7-Hydroxytetradecanoic Acid | starbld0001901 | DTXSID70560520 | SCHEMBL1882076 | 7-Hydroxy Myristic Acid | 7-hydroxy ...
- 7-Fluoro-benzo[d]imidazo[2,1-b]thiazole-2-carboxylic acid● In Stock — US warehouse, ships to EU* Item #: F336015View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 6-fluoroimidazo[2,1-b][1,3]benzothiazole-2-carboxylic acid;hydrate
- SMILES
- C1=CC2=C(C=C1F)SC3=NC(=CN23)C(=O)O.O
- InChIKey
- GELMDQDZZRDPOL-UHFFFAOYSA-N
- InChI
- 1S/C10H5FN2O2S.H2O/c11-5-1-2-7-8(3-5)16-10-12-6(9(14)15)4-13(7)10;/h1-4H,(H,14,15);1H2
- 7-Hydroxy Coumarin-d5CAS: 1215373-23-1 Formula: C9HD5O3 Molecular Weight: 167.17◐ .Made to order · 8–12 wks Item #: H333399View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 3,4,5,6,8-pentadeuterio-7-hydroxychromen-2-one
- SMILES
- C1=CC(=CC2=C1C=CC(=O)O2)O
- InChIKey
- ORHBXUUXSCNDEV-RALIUCGRSA-N
- InChI
- 1S/C9H6O3/c10-7-3-1-6-2-4-9(11)12-8(6)5-7/h1-5,10H/i1D,2D,3D,4D,5D
- Synonyms
- 7-Hydroxy-2-chromenone-d5 | Umbelliferone-d5 | 7-Hydroxy(~2~H_5_)-2H-1-benzopyran-2-one | 7-Hydroxy-2H-1-benzopyran-2...
- 7-Hydroxy chlorpromazine-d6 hydrochlorideCAS: 2095-62-7(unlabeled free base) Formula: C17H13D6ClN2OS • HCl Molecular Weight: 376.59● In Stock — US warehouse, ships to EU* Item #: H333385View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 8-chloro-10-[3-(dimethylamino)propyl]phenothiazin-3-ol
- SMILES
- CN(C)CCCN1C2=C(C=C(C=C2)O)SC3=C1C=C(C=C3)Cl
- InChIKey
- HICFFJZGXWEIHN-UHFFFAOYSA-N
- InChI
- 1S/C17H19ClN2OS/c1-19(2)8-3-9-20-14-6-5-13(21)11-17(14)22-16-7-4-12(18)10-15(16)20/h4-7,10-11,21H,3,8-9H2,1-2H3
- Synonyms
- PHENOTHIAZINE, 2-CHLORO-10-(3-(DIMETHYLAMINO)PROPYL)-7-HYDROXY- | UNII-P0X9L6UVP0 | CCG-37119 | MLS002920079 | NSC131...
- 7-Hydroxy-1-methyl-1H-indazole-3-carboxylic AcidCAS: 133841-11-9 Formula: C9H8N2O3 Molecular Weight: 192.17◐ .Made to order · 8–12 wks Item #: H334275View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 7-hydroxy-1-methylindazole-3-carboxylic acid
- SMILES
- CN1C2=C(C=CC=C2O)C(=N1)C(=O)O
- InChIKey
- IJFHHCNBYDCMBJ-UHFFFAOYSA-N
- InChI
- 1S/C9H8N2O3/c1-11-8-5(3-2-4-6(8)12)7(10-11)9(13)14/h2-4,12H,1H3,(H,13,14)
![7-Ethoxybenzo[b]furan-2-carboxylic acid - 97%, used for , CAS No. 206559-61-7, by Aladdin Scientific](https://www.aladdinsci.com/media/catalog/product/cache/6360e336b2a70951114dbd37294096ee/E/3/E336756.png)
![7-Fluoro-2,3,4,5-tetrahydro-1H-benzo[e][1,4]diazepine - 95%, used for , CAS No. 886366-21-8, by Aladdin Scientific](https://www.aladdinsci.com/media/catalog/product/cache/6360e336b2a70951114dbd37294096ee/F/3/F335988.png)
![Benzo[a]Pyren-7-Ol](https://www.aladdinsci.com/media/catalog/product/cache/6360e336b2a70951114dbd37294096ee/H/3/H333391.png)
![7-Fluoro-benzo[d]imidazo[2,1-b]thiazole-2-carboxylic acid - ≥95% CAS No(849924-90-9) by Aladdin Scientific](https://www.aladdinsci.com/media/catalog/product/cache/6360e336b2a70951114dbd37294096ee/F/3/F336015.png)
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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.