Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8953157038
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 | 17 USD | 95 | 8 working days | Get Quote |
| 5 mg | 17 USD | 95 | 8 working days | Get Quote |
| 10 mg | 17 USD | 95 | 8 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-8953157038.sdf |
| SMILES | MCULE-8953157038.smiles |
| Standard InChI | MCULE-8953157038.inchi |
| InChIKey | MCULE-8953157038.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867538762 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875694626 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-505390663 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-610979562 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 18.5 g |
| P-596926082 | Angene | Building Blocks in stock | 95 | As is | 10 g |
| P-494346464 | Apollo Scientific | In Stock | 95 | As is | 950 mg |
| P-864101275 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-481165797 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 194 g |
| P-868956789 | BLD pharm | In-stock building blocks | 95 | As is | unavailable |
| P-893221839 | Biosynth | In Stock | 95 | As is | in stock |
| P-851288128 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868599919 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-580442912 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-896533517 | FluoroChem | In Stock BB | 97 | As is | 1000 mg |
| P-590338433 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 1000 mg |
| P-890215999 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-454401890 | Key Organics | Building Blocks | 95 | As is | 839 mg |
| P-18791484 | Key Organics | Screening Compounds and Fragments | 95 | As is | 839 mg |
| P-588250611 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852412402 | Matrix Scientific | All | N/A | As is | in stock |
| P-519750060 | Maybridge | Maybridge Building Blocks | 97 | As is | 21 g |
| P-428010808 | Maybridge | Screening Collection | 97 | As is | 431 g |
| P-874442691 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-424917920 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885518132 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502385551 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611403157 | Toronto Research | In stock | 90 | As is | in stock |
| P-464678584 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 2.132 g |
| P-25583574 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 2.132 g |
| P-666975437 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 164.204 |
| logP | 1.8327 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 46.33 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 50.0604 |
| Atoms | 24 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 12 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
