Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8432649127-0
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 | 13 USD | 96 | 24 working days | Get Quote |
| 5 mg | 13 USD | 96 | 24 working days | Get Quote |
| 10 mg | 13 USD | 96 | 24 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-8432649127-0.sdf |
| SMILES | MCULE-8432649127-0.smiles |
| Standard InChI | MCULE-8432649127-0.inchi |
| InChIKey | MCULE-8432649127-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867608555 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875767488 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869183049 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505396345 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-851723984 | AmBeed | On request | N/A | As is | by synthesis |
| P-489155810 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-895096036 | Angene | Building Blocks in stock | 97 | As is | 250 g |
| P-589656952 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-591076381 | BLD pharm | Non-stock building blocks | 96 | As is | by synthesis |
| P-619831981 | ChemDiv | Discovery Chemistry Library | 90 | As is | 10 mg |
| P-868583883 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-34586241 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-861298609 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-889311058 | FluoroChem | General BB | N/A | As is | in stock |
| P-502528893 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-854062640 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-12644867 | InterBioScreen | Screening Compounds | 92 | As is | unavailable |
| P-619803440 | J&W Pharmlab | In-stock compounds | 98 | As is | in stock |
| P-524167993 | Key Organics | Building Blocks | 98 | As is | 5 g |
| P-855993186 | Key Organics | Screening Compounds and Fragments | 98 | As is | 100 mg |
| P-31179287 | LaboTest | Screening Collection | 90 | As is | 2 g |
| P-856043124 | LaboTest | Building Blocks | 90 | As is | 2 g |
| P-854831834 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-674718294 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-864655953 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
| P-500402569 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-24087606 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885542810 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-22810108 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502366037 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611402494 | Toronto Research | In stock | 90 | As is | in stock |
| P-2255892 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 115 mg |
| P-667013127 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 189.253 |
| logP | 2.5544 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 20.31 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 61.2785 |
| Atoms | 29 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 15 |
| 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 |
