Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9549005978
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 | 7 USD | 98 | 20 working days | Get Quote |
| 5 mg | 7 USD | 98 | 20 working days | Get Quote |
| 10 mg | 7 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-9549005978.sdf |
| SMILES | MCULE-9549005978.smiles |
| Standard InChI | MCULE-9549005978.inchi |
| InChIKey | MCULE-9549005978.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867567922 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-872935385 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875727602 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-875754930 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-597015045 | AEchem | Building blocks | 95 | As is | in stock |
| P-505351782 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-881671505 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893574271 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 4.60374 kg |
| P-606894220 | AmBeed | In stock | N/A | As is | in stock |
| P-606875003 | AmBeed | In stock | N/A | As is | in stock |
| P-489167280 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-875889551 | Angene | Building Blocks in stock | 98 | As is | 100 g |
| P-596948162 | Angene | Building Blocks in stock | 98 | As is | 25 g |
| P-494348554 | Apollo Scientific | In Stock | 95 | As is | 81 g |
| P-889792362 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-864085324 | AstaTech | In Stock BBs | 98 | As is | in stock |
| P-580732833 | BLD pharm | In-stock building blocks | 95 | As is | 680 g |
| P-863649976 | BLD pharm | In-stock building blocks | 98 | As is | 100 g |
| P-851244862 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-861282425 | Chiralstar | Chiralstar Building Blocks | 97 | As is | in stock |
| P-868573163 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-868590139 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580284379 | Debye Scientific | General Catalog | N/A | As is | by resynthesis (? - ? days) |
| P-861927966 | FluoroChem | General BB | 95 | As is | in stock |
| P-870662923 | Glentham Life Sciences | Compounds maintained in stock | 98 | As is | in stock |
| P-505497168 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-454394115 | Key Organics | Building Blocks | 97 | As is | 4.501 g |
| P-18813172 | Key Organics | Screening Compounds and Fragments | 97 | As is | 4.501 g |
| P-580465785 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852393463 | Matrix Scientific | All | N/A | As is | in stock |
| P-854738759 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-888898455 | PharmaBlock | In stock | N/A | As is | in stock |
| P-500382027 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-18942466 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885539413 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596763803 | Synthonix | In-stock Building Blocks | 98 | As is | 795 g |
| P-892284217 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892356909 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-502363810 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611433366 | Toronto Research | In stock | 90 | As is | in stock |
| P-3244189 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 26 mg |
| P-497596 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 26 mg |
| P-893947447 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-886909449 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 123.152 |
| logP | 0.9917 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 32.86 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 36.9947 |
| Atoms | 18 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 9 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
