Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2580495783
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 | 7 USD | 97 | 22 working days | Get Quote |
| 5 mg | 7 USD | 97 | 22 working days | Get Quote |
| 10 mg | 7 USD | 97 | 22 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-2580495783.sdf |
| SMILES | MCULE-2580495783.smiles |
| Standard InChI | MCULE-2580495783.inchi |
| InChIKey | MCULE-2580495783.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867658472 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-875827092 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869188337 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505354081 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-535624537 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-903201088 | Aaron Chemicals LLC | Predominantly Building Block | 99 | As is | 300 g |
| P-606890122 | AmBeed | In stock | N/A | As is | in stock |
| P-489149706 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596971680 | Angene | Building Blocks in stock | 99 | As is | 3 kg |
| P-580194988 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-895925857 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864141979 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580705182 | BLD pharm | In-stock building blocks | 97 | As is | 3.272 kg |
| P-901464526 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-505572756 | Bosche Scientific | Bosche Products | 98 | As is | in stock |
| P-851278570 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868592767 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-579804946 | Eximed | In-stock screening compounds | 90 | As is | in stock |
| P-901375185 | FluoroChem | In Stock BB | N/A | As is | 200 g |
| P-500419597 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-505493118 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-870569451 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-488555824 | InterBioScreen | Bioactive compounds | 92 | As is | in stock |
| P-488546860 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-524444047 | Key Organics | Biochemicals | 97 | As is | 100 mg |
| P-852467448 | Matrix Scientific | All | N/A | As is | in stock |
| P-863732977 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-899992885 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-474027399 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-608273518 | Molnova | Stock | 98 | As is | in stock |
| P-617666262 | Otava | In-House Stock Library | 90 | As is | 50 mg |
| P-454366642 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-885523683 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-23969644 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-579711602 | Selleck Biotechnology GmbH | Product Catalog | N/A | As is | in stock |
| P-869108158 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892286833 | TargetMol | In Stock BB | 95 | As is | 1.003 g |
| P-888627194 | TargetMol | Screening Compounds - stock amount | 95 | As is | 1.003 g |
| P-873214001 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-33162227 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 100 mg |
| P-611460424 | Toronto Research | In stock | 90 | As is | in stock |
| P-2376223 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.013 g |
| P-3227621 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.013 g |
| P-893889156 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 247.274 |
| logP | 2.1384 |
| H-bond acceptors | 7 |
| H-bond donors | 0 |
| Rotatable bonds | 5 |
| PSA | 106.16 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 60.662 |
| Atoms | 29 |
| Rings | 1 |
| Heavy atoms | 16 |
| Hydrogen atoms | 13 |
| Heteroatoms | 8 |
| N/O atoms | 7 |
| 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 |
