Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4300468075
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 | 33 USD | 90 | 17 working days | Get Quote |
| 5 mg | 39 USD | 98 | 20 working days | Get Quote |
| 10 mg | 39 USD | 98 | 20 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-4300468075.sdf |
| SMILES | MCULE-4300468075.smiles |
| Standard InChI | MCULE-4300468075.inchi |
| InChIKey | MCULE-4300468075.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867608170 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875766969 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-613854679 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-489175223 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-619180251 | Angene | Building Blocks in stock | 98 | As is | 10 g |
| P-494327120 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-596293426 | Asinex | General screening catalog | 90 | As is | 264 mg |
| P-889775932 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-860056790 | AvaChem Scientific | All products | 98 | As is | by synthesis |
| P-868544288 | Axon Medchem | Axon predominantly SC catalog | 99 | As is | in stock |
| P-4326069 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 100 mg |
| P-580452730 | CliniSciences S.A.S | All products | 98 | As is | in stock |
| P-887225768 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-580273396 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-870660353 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-855913633 | Key Organics | Building Blocks | 97 | As is | 5 mg |
| P-579674425 | LabSeeker, Inc | On demand Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-519750041 | Maybridge | Maybridge Building Blocks | 97 | As is | 1.5 g |
| P-35203317 | Maybridge | Screening Collection | 97 | As is | 9.593 kg |
| P-872528950 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-871077177 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-608274520 | Molnova | Stock | 98 | As is | in stock |
| P-500391232 | Pi Chemicals | Virtual Compounds | 97 | As is | by synthesis |
| P-18894211 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-888640099 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869126834 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-23337239 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
| P-596714483 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 20 mg |
| P-855006594 | Toronto Research | In stock | 90 | As is | in stock |
| P-2549854 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 7 mg |
| P-868507421 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 426.145 |
| logP | 4.242 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 28.4 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 99.3918 |
| Atoms | 40 |
| Rings | 3 |
| Heavy atoms | 22 |
| Hydrogen atoms | 18 |
| Heteroatoms | 5 |
| N/O atoms | 3 |
| 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 |
