Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8900472970
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 | 65 USD | 95 | 10 working days | Get Quote |
| 5 mg | 81 USD | 95 | 10 working days | Get Quote |
| 10 mg | 103 USD | 95 | 18 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-8900472970.sdf |
| SMILES | MCULE-8900472970.smiles |
| Standard InChI | MCULE-8900472970.inchi |
| InChIKey | MCULE-8900472970.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867542831 | A2B Chem | Predominantly Building Block in stock | 96 | As is | in stock |
| P-875699335 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590369048 | AK Scientific | Building Blocks | 96 | As is | in stock |
| P-610980416 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 33.481 g |
| P-851884585 | AmBeed | On request | N/A | As is | by synthesis |
| P-873289163 | Angene | Building Blocks in stock | 97 | As is | 5 g |
| P-864092536 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-591033468 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-861550539 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-580296092 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-862022419 | FluoroChem | General BB | N/A | As is | in stock |
| P-454398799 | Key Organics | Building Blocks | 95 | As is | 148 mg |
| P-454312035 | Key Organics | Screening Compounds and Fragments | 95 | As is | 148 mg |
| P-25841553 | Life Chemicals | Building Blocks | 95 | As is | 3.422 g |
| P-601073440 | Life Chemicals | Screening Compounds | 90 | As is | 3.422 g |
| P-852509904 | Matrix Scientific | All | N/A | As is | in stock |
| P-519754627 | Maybridge | Maybridge Building Blocks | 97 | As is | 129.199 g |
| P-854769704 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-502398201 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611533715 | Toronto Research | In stock | 90 | As is | in stock |
| P-886930435 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 199.205 |
| logP | 2.6864 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 39.19 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 56.1405 |
| Atoms | 24 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 9 |
| 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 |
