Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7716887377-0
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 | 9 USD | 98 | 20 working days | Get Quote |
| 5 mg | 9 USD | 98 | 20 working days | Get Quote |
| 10 mg | 9 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-7716887377-0.sdf |
| SMILES | MCULE-7716887377-0.smiles |
| Standard InChI | MCULE-7716887377-0.inchi |
| InChIKey | MCULE-7716887377-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867576989 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875737397 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-881662330 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-868817043 | AmBeed | On request | N/A | As is | by synthesis |
| P-489188815 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596988193 | Angene | Building Blocks in stock | 98 | As is | 175 g |
| P-552040225 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-898224868 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 3 g |
| P-454684236 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-436442942 | Chemical Block | Building Blocks | 90 | As is | unavailable |
| P-861284198 | Chiralstar | Chiralstar Building Blocks | 95 | As is | in stock |
| P-868615092 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-580416449 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-861917975 | FluoroChem | General BB | N/A | As is | in stock |
| P-502509392 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-488546725 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-31258459 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-613281740 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-852378818 | Matrix Scientific | All | N/A | As is | in stock |
| P-519763489 | Maybridge | Maybridge Building Blocks | 97 | As is | 50.4 g |
| P-454366577 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-579267549 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885528717 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-873283432 | Shanghai iChemical | In stock | N/A | As is | in stock |
| P-502328332 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-854998955 | Toronto Research | In stock | 90 | As is | in stock |
| P-580449709 | Trans World Chemicals | A-chem Products | 97 | As is | in stock |
| P-615413500 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 165.214 |
| logP | 2.4295 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 53.68 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 47.62 |
| Atoms | 18 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 7 |
| Heteroatoms | 3 |
| 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 |
