Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5261994676-1
Structure
Show compound
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 | 34 USD | 90 | 19 working days | Get Quote |
| 5 mg | 39 USD | 95 | 18 working days | Get Quote |
| 10 mg | 39 USD | 95 | 18 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-5261994676-1.sdf |
| SMILES | MCULE-5261994676-1.smiles |
| Standard InChI | MCULE-5261994676-1.inchi |
| InChIKey | MCULE-5261994676-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867665082 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875833682 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869184394 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505400808 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-580233744 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-617054142 | Allbio Pharm | Backorder | N/A | As is | by resynthesis (? - ? days) |
| P-851815126 | AmBeed | On request | N/A | As is | by synthesis |
| P-489110317 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-597010659 | Angene | Building Blocks in stock | 97 | As is | 1000 mg |
| P-596471822 | Asinex | General screening catalog | 90 | As is | 101 mg |
| P-864110503 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-591094021 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-893233789 | Biosynth | In Stock | 95 | As is | in stock |
| P-504764994 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 9 mg |
| P-851240955 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868622990 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-861974796 | FluoroChem | General BB | 95 | As is | in stock |
| P-524169675 | Key Organics | Building Blocks | 98 | As is | 100 mg |
| P-852520041 | Matrix Scientific | All | N/A | As is | in stock |
| P-854784951 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-894587651 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-491426490 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-896084410 | Specs | Repurposed Compounds | N/A | As is | 10 mg |
| P-502330330 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22497248 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 1000 mg |
| P-611487066 | Toronto Research | In stock | 90 | As is | in stock |
| P-892378669 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1 mg |
| P-481001130 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 209.224 |
| logP | 2.0031 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 87.66 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 53.0713 |
| Atoms | 21 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 7 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| 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 |
