Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9863396704
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 | 22 USD | N/A | 9 working days | Get Quote |
| 5 mg | 22 USD | N/A | 9 working days | Get Quote |
| 10 mg | 22 USD | N/A | 9 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-9863396704.sdf |
| SMILES | MCULE-9863396704.smiles |
| Standard InChI | MCULE-9863396704.inchi |
| InChIKey | MCULE-9863396704.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875757912 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590356394 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893485141 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 400 g |
| P-436472209 | Alinda | Building Blocks | 95 | As is | 1000 mg |
| P-34884431 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-851936063 | AmBeed | In stock | N/A | As is | in stock |
| P-489201445 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596984776 | Angene | Building Blocks in stock | 98 | As is | 400 g |
| P-864176876 | AstaTech | In Stock BBs | 98 | As is | in stock |
| P-893265566 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-454728645 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-868606448 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580303127 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-428631004 | Eximed | In-stock screening compounds | 90 | As is | 1000 mg |
| P-862022236 | FluoroChem | General BB | N/A | As is | in stock |
| P-500417576 | Glentham Life Sciences | Compounds maintained in stock | 99 | As is | in stock |
| P-890219422 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-590341991 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 5.02 g |
| P-502967216 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-580005933 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-855955091 | Key Organics | Building Blocks | 97 | As is | 5 g |
| P-596572734 | Key Organics | Building Blocks | 97 | As is | 1000 mg |
| P-856040908 | LaboTest | Building Blocks | 90 | As is | 10 g |
| P-31139190 | LaboTest | Screening Collection | 90 | As is | 10 g |
| P-852531999 | Matrix Scientific | All | N/A | As is | in stock |
| P-35170173 | Maybridge | Screening Collection | 90 | As is | 5.822 kg |
| P-895293989 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-19518908 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885517288 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-892261403 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892342832 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-502364896 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-33163700 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 979 mg |
| P-611586140 | Toronto Research | In stock | 90 | As is | in stock |
| P-578063126 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 55 mg |
| P-893965077 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 188.224 |
| logP | 0.6518 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 6 |
| PSA | 92.42 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 48.0509 |
| Atoms | 29 |
| Rings | 0 |
| Heavy atoms | 13 |
| Hydrogen atoms | 16 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
