Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2458697774
Compound
Show structure
In order to add this molecule to a collection you have to create an account.
Sign up for free
- InChIKey:
- SMILES:
- InChI:
- Formula:
| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
|---|---|---|---|---|
| 1 mg | 5 USD | 95 | 10 working days | Get Quote |
| 5 mg | 5 USD | 95 | 10 working days | Get Quote |
| 10 mg | 5 USD | 95 | 10 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
- Toxicity checker Searching for substructures commonly found in toxic and promiscuous ligands.
- Property calculator Create a physicochemical property profile for the compound in a second.
- Similarity search Find analogs by similarity search.
- Substructure search Find analogs by substructure search.
-
1
MCULE-9197553017
- Component type: Main
-
2
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2458697774.sdf |
| SMILES | MCULE-2458697774.smiles |
| Standard InChI | MCULE-2458697774.inchi |
| InChIKey | MCULE-2458697774.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-893485911 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 1.013 kg |
| P-887178875 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-895721731 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-893763266 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| P-892870663 | A2B Chem | Predominantly Building Block in stock | 96 | Main component | in stock |
| P-889946635 | AA Blocks | AA Blocks - synthesis | N/A | Main component | by synthesis |
| P-517095670 | Alinda | Stock Screening Compounds | 90 | Main component | in stock |
| P-851792332 | AmBeed | On request | N/A | Main component | by synthesis |
| P-489172320 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component | in stock |
| P-892191703 | Angene | Building Blocks in stock | 95 | Main component | 25 g |
| P-864215527 | AstaTech | Backordered BBs | 95 | Main component | by synthesis |
| P-590973700 | BLD pharm | Non-stock building blocks | 98 | Main component | by synthesis |
| P-893226887 | Biosynth | In Stock | 95 | Main component | in stock |
| P-868579329 | Combi-Blocks | Building Block in stock | 98 | Main component | in stock |
| P-580404345 | Debye Scientific | General Catalog | 95 | Main component | by resynthesis (? - ? days) |
| P-862010299 | FluoroChem | General BB | 95 | Main component | in stock |
| P-505530758 | Hangzhou Apichem | Building Blocks in stock | 95 | Main component | in stock |
| P-855938579 | Key Organics | Building Blocks | 97 | Main component | 5 mg |
| P-855961649 | Key Organics | Building Blocks | 95 | Main component | 100 mg |
| P-563404286 | Key Organics | Building Blocks | 95 | Main component | 5 g |
| P-579614604 | LabSeeker, Inc | Stock Collection | 98 | Main component | in stock |
| P-580498328 | Manchester Organics | Compounds on demand | 98 | Main component | by synthesis |
| P-852607643 | Matrix Scientific | All | N/A | Main component | in stock |
| P-895522376 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-500370607 | Pi Chemicals | Virtual Compounds | 98 | Main component | by synthesis |
| P-888592087 | TimTec | ActiMol 4 Week - On demand | 94 | Main component | by resynthesis (? - ? days) |
| P-611349610 | Toronto Research | In stock | 90 | Main component | in stock |
| P-886918423 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component | by synthesis |
| P-867568461 | A2B Chem | Predominantly Building Block in stock | 98 | Main component as a main component | in stock |
| P-867574993 | A2B Chem | Predominantly Building Block in stock | 98 | Main component as a main component | in stock |
| P-867431271 | A2B Chem | Predominantly Building Block on demand | N/A | Main component as a main component | by synthesis |
| P-875728689 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-875734822 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-597023806 | AEchem | Building blocks | 95 | Main component as a main component | in stock |
| P-869189386 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-869193295 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-505353032 | AK Scientific | Building Blocks | 98 | Main component as a main component | in stock |
| P-505391818 | AK Scientific | Building Blocks | 98 | Main component as a main component | in stock |
| P-590410528 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-580198762 | Aldlab Chemicals | Building Block Stock | 95 | Main component as a main component | 37 g |
| P-851924950 | AmBeed | In stock | N/A | Main component as a main component | in stock |
| P-606879103 | AmBeed | In stock | N/A | Main component as a main component | in stock |
| P-489235186 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component as a main component | in stock |
| P-489184107 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component as a main component | in stock |
| P-596988003 | Angene | Building Blocks in stock | 97 | Main component as a main component | 408 g |
| P-596930026 | Angene | Building Blocks in stock | 98 | Main component as a main component | 257 g |
| P-872723528 | Apexbio Technology | Bioactive Compound Library | 98 | Main component as a main component | in stock |
| P-494331669 | Apollo Scientific | On request | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-864106611 | AstaTech | In Stock BBs | 95 | Main component as a main component | in stock |
| P-864101606 | AstaTech | In Stock BBs | 95 | Main component as a main component | in stock |
| P-580722057 | BLD pharm | In-stock building blocks | 97 | Main component as a main component | 272 g |
| P-893227833 | Biosynth | In Stock | 95 | Main component as a main component | in stock |
| P-861411614 | Combi-Blocks | Building Block on demand | 95 | Main component as a main component | by synthesis |
| P-868598534 | Combi-Blocks | Building Block in stock | 98 | Main component as a main component | in stock |
| P-861980012 | FluoroChem | General BB | 95 | Main component as a main component | in stock |
| P-861969091 | FluoroChem | General BB | 95 | Main component as a main component | in stock |
| P-870647419 | Glentham Life Sciences | Compounds typically in stock | N/A | Main component as a main component | in stock |
| P-870647488 | Glentham Life Sciences | Compounds typically in stock | 98 | Main component as a main component | in stock |
| P-870648020 | Glentham Life Sciences | Compounds typically in stock | N/A | Main component as a main component | in stock |
| P-505520847 | Hangzhou Apichem | Building Blocks in stock | 95 | Main component as a main component | in stock |
| P-563383528 | Key Organics | Building Blocks | 95 | Main component as a main component | 5 g |
| P-454420471 | Key Organics | Building Blocks | 95 | Main component as a main component | 5 g |
| P-579619688 | LabSeeker, Inc | Stock Collection | 98 | Main component as a main component | in stock |
| P-31248600 | LaboTest | Screening Collection | 90 | Main component as a main component | unavailable |
| P-31275619 | LaboTest | Screening Collection | 90 | Main component as a main component | 10 g |
| P-856039716 | LaboTest | Building Blocks | 90 | Main component as a main component | 10 g |
| P-611663165 | Manchester Organics | Compounds on demand | 99 | Main component as a main component | by synthesis |
| P-852579407 | Matrix Scientific | All | N/A | Main component as a main component | in stock |
| P-854692560 | MedChemExpress | Natural Products In stock | 95 | Main component as a main component | in stock |
| P-619672671 | Molnova | Stock | 98 | Main component as a main component | in stock |
| P-500404045 | Pi Chemicals | Virtual Compounds | 98 | Main component as a main component | by synthesis |
| P-500408309 | Pi Chemicals | Virtual Compounds | 98 | Main component as a main component | by synthesis |
| P-885550768 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component as a main component | by synthesis |
| P-889871822 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component as a main component | by synthesis |
| P-594273676 | TargetMol | Screening Compounds - synthesis | 95 | Main component as a main component | by synthesis |
| P-892295281 | TargetMol | In Stock BB | 95 | Main component as a main component | unavailable |
| P-892337679 | TargetMol | Screening Compounds - stock amount | 95 | Main component as a main component | 204 mg |
| P-502368670 | TimTec | Building Block Collection | 90 | Main component as a main component | in stock |
| P-611349611 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-611582416 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-575318047 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component as a main component | in stock |
| P-615404176 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component as a main component | in stock |
| P-615433932 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 177.027 |
| logP | 1.3616 |
| H-bond acceptors | 4 |
| H-bond donors | 3 |
| Rotatable bonds | 2 |
| PSA | 89.34 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 37.6516 |
| Atoms | 19 |
| Rings | 0 |
| Heavy atoms | 9 |
| Hydrogen atoms | 10 |
| Heteroatoms | 6 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
