Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9155785460
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 | 24 USD | 97 | 20 working days | Get Quote |
| 5 mg | 24 USD | 97 | 20 working days | Get Quote |
| 10 mg | 24 USD | 97 | 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.
| Name | File |
|---|---|
| SDF | MCULE-9155785460.sdf |
| SMILES | MCULE-9155785460.smiles |
| Standard InChI | MCULE-9155785460.inchi |
| InChIKey | MCULE-9155785460.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867613804 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875774594 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-612942474 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-610984082 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 143.93 g |
| P-606869849 | AmBeed | In stock | N/A | As is | in stock |
| P-596963268 | Angene | Building Blocks in stock | 97 | As is | 5.7 g |
| P-895929665 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864147578 | AstaTech | In Stock BBs | 98 | As is | in stock |
| P-590709862 | BLD pharm | In-stock building blocks | 97 | As is | 2.41 g |
| P-4434810 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 25 mg |
| P-870581028 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-862021371 | FluoroChem | General BB | 95 | As is | in stock |
| P-596571448 | Key Organics | Building Blocks | 97 | As is | 100 mg |
| P-615654193 | LabNetwork | In stock | 95 | As is | in stock |
| P-854744141 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-888883131 | PharmaBlock | In stock | N/A | As is | in stock |
| P-889862694 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-579708596 | Sinova Inc. | In-stock Building Blocks | N/A | As is | in stock |
| P-453956323 | Specs | Screening Compounds | 90 | As is | 90 mg |
| P-596775167 | Synthonix | In-stock Building Blocks | 95 | As is | 66.09 g |
| P-873222486 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-855134177 | Toronto Research | In stock | 90 | As is | in stock |
| P-588802123 | VITAS M CHEMICAL LIMITED | Virtual synthesis library | N/A | As is | by synthesis |
| P-886916154 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 206.280 |
| logP | 3.4515 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 37.3 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 63.0125 |
| Atoms | 33 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 18 |
| 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 |
