Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1651525179
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 | 25 USD | 98 | 22 working days | Get Quote |
| 5 mg | 62 USD | 98 | 19 working days | Get Quote |
| 10 mg | 81 USD | 98 | 19 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-1651525179.sdf |
| SMILES | MCULE-1651525179.smiles |
| Standard InChI | MCULE-1651525179.inchi |
| InChIKey | MCULE-1651525179.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867627236 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-505346970 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-893482087 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 350 mg |
| P-606853229 | AmBeed | In stock | N/A | As is | in stock |
| P-596965809 | Angene | Building Blocks in stock | 97 | As is | 250 mg |
| P-580195595 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-896033381 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-868543629 | Axon Medchem | Axon predominantly SC catalog | 99 | As is | in stock |
| P-851278776 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-860799275 | Chiralstar | Chiralstar Building Blocks | 98 | As is | in stock |
| P-870660548 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-675215705 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-524439924 | Key Organics | Biochemicals | 97 | As is | 459 mg |
| P-889882150 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-579712668 | Selleckchem | Product Catalog | N/A | As is | in stock |
| P-525186094 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892298113 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-888657998 | TargetMol | Screening Compounds - stock amount | 95 | As is | 145 mg |
| P-611472021 | Toronto Research | In stock | 90 | As is | in stock |
| P-868492899 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 371.455 |
| logP | 3.8553 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 90.65 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 104.7184 |
| Atoms | 47 |
| Rings | 4 |
| Heavy atoms | 26 |
| Hydrogen atoms | 21 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
