Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5482365936
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 | 36 USD | 95 | 14 working days | Get Quote |
| 5 mg | 36 USD | 95 | 14 working days | Get Quote |
| 10 mg | 41 USD | 95 | 14 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-5482365936.sdf |
| SMILES | MCULE-5482365936.smiles |
| Standard InChI | MCULE-5482365936.inchi |
| InChIKey | MCULE-5482365936.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852140443 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-889959951 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-894621861 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-436463953 | Alinda | Building Blocks | 95 | As is | 2 g |
| P-851486130 | AmBeed | On request | N/A | As is | by synthesis |
| P-901359719 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-590822569 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-3988963 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 100 mg |
| P-577175719 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
| P-619272882 | ChemDiv | Discovery Chemistry Library | 90 | As is | 18 mg |
| P-861531161 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-502504426 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-502677524 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-675482886 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-492233737 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-855975052 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-852434438 | Matrix Scientific | All | N/A | As is | in stock |
| P-854952268 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-19076359 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-19807024 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-491181488 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-23322148 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
| P-873233946 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-855310939 | Toronto Research | In stock | 90 | As is | in stock |
| P-588839047 | VITAS M CHEMICAL LIMITED | Virtual synthesis library | N/A | As is | by synthesis |
| P-617781662 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 25 mg |
| P-3239097 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 67 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 213.346 |
| logP | 1.9994 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 59.39 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 73.9914 |
| Atoms | 33 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 19 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
