Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2121956988
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 | 34 USD | 90 | 17 working days | Get Quote |
| 5 mg | 50 USD | 90 | 17 working days | Get Quote |
| 10 mg | 64 USD | 90 | 17 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.
-
1
MCULE-2792749079
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2121956988.sdf |
| SMILES | MCULE-2121956988.smiles |
| Standard InChI | MCULE-2121956988.inchi |
| InChIKey | MCULE-2121956988.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-612938714 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-610899824 | Advanced ChemBlocks Inc (AChemBlock) | On demand | 90 | As is | by synthesis |
| P-851637768 | AmBeed | On request | N/A | As is | by synthesis |
| P-889851942 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-590979186 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-3835399 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 5 mg |
| P-887318846 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-889405182 | FluoroChem | General BB | N/A | As is | in stock |
| P-852384813 | Matrix Scientific | All | N/A | As is | in stock |
| P-864039029 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-675100800 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-855217638 | Toronto Research | In stock | 90 | As is | in stock |
| P-617781495 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 89 mg |
| P-612942793 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-852391410 | Matrix Scientific | All | N/A | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 241.755 |
| logP | 3.5042 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 21.26 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 73.5027 |
| Atoms | 36 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 20 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
