Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4594335775
Compound
Show structures
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 | 6 USD | N/A | 14 working days | Get Quote |
| 5 mg | 8 USD | 98 | 16 working days | Get Quote |
| 10 mg | 10 USD | 98 | 16 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.
| Name | File |
|---|---|
| SDF | MCULE-4594335775.sdf |
| SMILES | MCULE-4594335775.smiles |
| Standard InChI | MCULE-4594335775.inchi |
| InChIKey | MCULE-4594335775.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867630947 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875794615 | AA Blocks | AA Blocks | N/A | As is | in stock |
| P-874619582 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-425243650 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-606937425 | AmBeed | In stock | N/A | As is | in stock |
| P-596966345 | Angene | Building Blocks in stock | 98 | As is | 4.577 g |
| P-872725680 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-864193971 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-860056367 | AvaChem Scientific | All products | 98 | As is | by synthesis |
| P-580731852 | BLD pharm | In-stock building blocks | 98 | As is | 4.577 g |
| P-7532091 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 100 mg |
| P-584591106 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-3616549 | ChemDiv | Discovery Chemistry Library | 90 | As is | 12.295 g |
| P-860798363 | Chiralstar | Chiralstar Building Blocks | 98 | As is | in stock |
| P-861367278 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-887200538 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-579478517 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-870652691 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-675215835 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-503059629 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-502610644 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-488556151 | InterBioScreen | Bioactive compounds | 92 | As is | in stock |
| P-596583414 | Key Organics | Building Blocks | 97 | As is | 5 mg |
| P-854717016 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-474025073 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-608274892 | Molnova | Stock | 98 | As is | in stock |
| P-608280457 | Molnova | Stock | 98 | As is | in stock |
| P-26459288 | Otava | In-House Stock Library | 90 | As is | 70 mg |
| P-617701150 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1.599 g |
| P-12893039 | Otava | In-House Stock Library | 90 | As is | 1.599 g |
| P-491318672 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-18871255 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-579713150 | Selleckchem | Product Catalog | N/A | As is | in stock |
| P-888655754 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-525178093 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-33163110 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 60 mg |
| P-611458707 | Toronto Research | In stock | 90 | As is | in stock |
| P-611457218 | Toronto Research | In stock | 90 | As is | in stock |
| P-1029411 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 165 mg |
| P-480851880 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
| P-868496658 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 292.355 |
| logP | 2.4057 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 4 |
| PSA | 102.68 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 87.0014 |
| Atoms | 36 |
| Rings | 2 |
| Heavy atoms | 20 |
| Hydrogen atoms | 16 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
