Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4720986345
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 | 10 USD | 98 | 14 working days | Get Quote |
| 5 mg | 10 USD | 98 | 14 working days | Get Quote |
| 10 mg | 10 USD | 98 | 14 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-4720986345.sdf |
| SMILES | MCULE-4720986345.smiles |
| Standard InChI | MCULE-4720986345.inchi |
| InChIKey | MCULE-4720986345.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-903073539 | Aaron Chemicals LLC | Predominantly Building Block | 97 | As is | 25 g |
| P-893471605 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 368.8 g |
| P-489167046 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-613260753 | BLD pharm | In-stock building blocks | 95 | As is | 7.1 g |
| P-900267375 | BOC Sciences | All products | N/A | As is | by resynthesis (? - ? days) |
| P-851262194 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868602619 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-901376085 | FluoroChem | In Stock BB | N/A | As is | 2 g |
| P-896628416 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
| P-854714606 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-878645361 | Molnova | Stock | 98 | As is | in stock |
| P-888850317 | PharmaBlock | In stock | N/A | As is | in stock |
| P-617403269 | Selleck Biotechnology GmbH | Product Catalog | N/A | As is | in stock |
| P-873285425 | Shanghai iChemical | In stock | N/A | As is | in stock |
| P-613807408 | Spirochem | All | 95 | As is | in stock |
| P-867585350 | A2B Chem | Predominantly Building Block in stock | 95 | As an isomer | in stock |
| P-875743488 | AA Blocks | AA Blocks - in stock | N/A | As an isomer | in stock |
| P-590369224 | AK Scientific | Building Blocks | 95 | As an isomer | in stock |
| P-903073800 | Aaron Chemicals LLC | Predominantly Building Block | 98 | As an isomer | 400 g |
| P-893518064 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As an isomer | 303.4 g |
| P-596953955 | Angene | Building Blocks in stock | 98 | As an isomer | 50 g |
| P-864088928 | AstaTech | In Stock BBs | 97 | As an isomer | in stock |
| P-580708824 | BLD pharm | In-stock building blocks | 97 | As an isomer | 41.5 g |
| P-851309435 | Chemshuttle | On request catalog | 95 | As an isomer | by synthesis |
| P-868649204 | Combi-Blocks | Building Block in stock | 95 | As an isomer | in stock |
| P-889116515 | FluoroChem | In Stock BB | N/A | As an isomer | 2 g |
| P-870648845 | Glentham Life Sciences | Compounds typically in stock | N/A | As an isomer | in stock |
| P-870648847 | Glentham Life Sciences | Compounds typically in stock | 97 | As an isomer | in stock |
| P-596577152 | Key Organics | Building Blocks | 97 | As an isomer | 1000 mg |
| P-563565199 | Key Organics | Building Blocks | 95 | As an isomer | 250 mg |
| P-524197293 | Key Organics | Building Blocks | 97 | As an isomer | 5 g |
| P-615638099 | LabNetwork | In stock | 95 | As an isomer | in stock |
| P-31175133 | LaboTest | Screening Collection | 90 | As an isomer | unavailable |
| P-863732442 | MedChemExpress | Screening compounds In stock | 95 | As an isomer | in stock |
| P-878647073 | Molnova | Stock | 98 | As an isomer | in stock |
| P-885540871 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As an isomer | by synthesis |
| P-505618664 | Ramidus | In stock compounds | 95 | As an isomer | in stock |
| P-869125807 | TargetMol | Screening Compounds - synthesis | 95 | As an isomer | by synthesis |
| P-892290800 | TargetMol | In Stock BB | 95 | As an isomer | unavailable |
| P-888639301 | TargetMol | Screening Compounds - stock amount | 95 | As an isomer | 100 mg |
| P-502338019 | TimTec | Building Block Collection | 90 | As an isomer | in stock |
| P-33163064 | TimTec | ActiMol 1 Week - Stock | 90 | As an isomer | 1000 mg |
| P-611615550 | Toronto Research | In stock | 90 | As an isomer | in stock |
| P-611420007 | Toronto Research | In stock | 90 | As an isomer | in stock |
| P-611528177 | Toronto Research | In stock | 90 | As an isomer | in stock |
| P-3247314 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As an isomer | unavailable |
| P-893981182 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As an isomer | in stock |
| P-575317830 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As an isomer | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 195.215 |
| logP | 1.437 |
| H-bond acceptors | 4 |
| H-bond donors | 3 |
| Rotatable bonds | 3 |
| PSA | 83.55 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 52.3692 |
| Atoms | 27 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 13 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
