Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7222676614
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 | 32 USD | 95 | 13 working days | Get Quote |
| 5 mg | 32 USD | 95 | 13 working days | Get Quote |
| 10 mg | 37 USD | 98 | 16 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-7222676614.sdf |
| SMILES | MCULE-7222676614.smiles |
| Standard InChI | MCULE-7222676614.inchi |
| InChIKey | MCULE-7222676614.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-610891019 | Advanced ChemBlocks Inc (AChemBlock) | On demand | 90 | As is | by synthesis |
| P-489172120 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-860055545 | AvaChem Scientific | All products | 95 | As is | by synthesis |
| P-851278166 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868601236 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-579478655 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-862000522 | FluoroChem | General BB | N/A | As is | in stock |
| P-852494755 | Matrix Scientific | All | N/A | As is | in stock |
| P-474027182 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-608274979 | Molnova | Stock | 98 | As is | in stock |
| P-579710338 | Selleckchem | Product Catalog | N/A | As is | in stock |
| P-436470457 | Alinda | Building Blocks | 95 | As an isomer | in stock |
| P-869448438 | Asinex | General screening catalog | 90 | As an isomer | 91 mg |
| P-454725102 | ChemDiv | Building Blocks in stock | 90 | As an isomer | in stock |
| P-861285436 | Chiralstar | Chiralstar Building Blocks | 95 | As an isomer | in stock |
| P-870654516 | Glentham Life Sciences | Compounds typically in stock | N/A | As an isomer | in stock |
| P-870654679 | Glentham Life Sciences | Compounds typically in stock | N/A | As an isomer | in stock |
| P-500418184 | Glentham Life Sciences | Compounds maintained in stock | 99 | As an isomer | in stock |
| P-500418220 | Glentham Life Sciences | Compounds maintained in stock | 99 | As an isomer | in stock |
| P-502796679 | Innovapharm | Screening Compounds | 90 | As an isomer | in stock |
| P-31156574 | LaboTest | Screening Collection | 90 | As an isomer | 500 mg |
| P-608279810 | Molnova | Stock | 98 | As an isomer | in stock |
| P-19202686 | Princeton Biomolecular Research | Screening Compounds | 90 | As an isomer | in stock |
| P-885522531 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As an isomer | by synthesis |
| P-33162563 | TimTec | ActiMol 1 Week - Stock | 90 | As an isomer | 1000 mg |
| P-1252894 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As an isomer | 1.403 g |
| P-3216616 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As an isomer | 1.403 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 242.228 |
| logP | -1.5143 |
| H-bond acceptors | 7 |
| H-bond donors | 3 |
| Rotatable bonds | 2 |
| PSA | 104.55 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 58.0733 |
| Atoms | 31 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 14 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 3 |
| 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 |
