Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
UNKNOWN STEREO
MCULE-9828778245-0
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 | 7 USD | 99 | 20 working days | Get Quote |
| 5 mg | 7 USD | 99 | 20 working days | Get Quote |
| 10 mg | 7 USD | 99 | 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.
-
MCULE-9509659105-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-9828778245-0.sdf |
| SMILES | MCULE-9828778245-0.smiles |
| Standard InChI | MCULE-9828778245-0.inchi |
| InChIKey | MCULE-9828778245-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867515604 | A2B Chem | Predominantly Building Block on demand | 98 | As is | by synthesis |
| P-890156778 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-892510483 | AmBeed | In stock | N/A | As is | in stock |
| P-873294647 | Angene | Building Blocks in stock | 98 | As is | 20 g |
| P-596518545 | Asinex | General bb catalog | 90 | As is | unavailable |
| P-889585815 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-892263698 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892345007 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-867587221 | A2B Chem | Predominantly Building Block in stock | 99 | As a main component | in stock |
| P-875746149 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-535626679 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
| P-505353554 | AK Scientific | Building Blocks | 98 | As a main component | in stock |
| P-580238259 | Aldlab Chemicals | Building Block Custom Synth | 95 | As a main component | by synthesis |
| P-606950798 | AmBeed | In stock | N/A | As a main component | in stock |
| P-596954762 | Angene | Building Blocks in stock | 99 | As a main component | 7.5 kg |
| P-892495490 | Asinex | General screening catalog | 90 | As a main component | 1000 mg |
| P-864110586 | AstaTech | In Stock BBs | 95 | As a main component | in stock |
| P-580426785 | Debye Scientific | General Catalog | 95 | As a main component | by resynthesis (? - ? days) |
| P-505505237 | Hangzhou Apichem | Building Blocks in stock | 95 | As a main component | in stock |
| P-492241861 | Innovapharm | Building Blocks | 95 | As a main component | in stock |
| P-488543815 | InterBioScreen | Building Blocks | 90 | As a main component | in stock |
| P-24485991 | InterBioScreen | Natural Compounds | 92 | As a main component | 300 mg |
| P-592695889 | Otava | Virtual BB | 95 | As a main component | by synthesis |
| P-454363776 | Pharmeks LLC | Building Blocks | 92 | As a main component | in stock |
| P-575380173 | Pharmeks LLC | Semi-natural compounds | 92 | As a main component | 300 mg |
| P-500403537 | Pi Chemicals | Virtual Compounds | 98 | As a main component | by synthesis |
| P-873237326 | TimTec | Building Block Collection | 90 | As a main component | in stock |
| P-575327041 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 131.173 |
| logP | 0.843 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 52.32 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 34.9484 |
| Atoms | 22 |
| Rings | 0 |
| Heavy atoms | 9 |
| Hydrogen atoms | 13 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
