Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3741983922
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 | 45 USD | 90 | 23 working days | Get Quote |
| 5 mg | 73 USD | 90 | 23 working days | Get Quote |
| 10 mg | 87 USD | 90 | 23 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.
-
MCULE-4486377116
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3741983922.sdf |
| SMILES | MCULE-3741983922.smiles |
| Standard InChI | MCULE-3741983922.inchi |
| InChIKey | MCULE-3741983922.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-612859811 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-890159302 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590371600 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-872944327 | AmBeed | On request | N/A | As is | by synthesis |
| P-489222602 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-889448573 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-608392890 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-851264775 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868625492 | Combi-Blocks | Building Block in stock | 96 | As is | in stock |
| P-580439641 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-862021591 | FluoroChem | General BB | N/A | As is | in stock |
| P-524183104 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-863734895 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
| P-492274594 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 928 mg |
| P-12392227 | Otava | In-House Stock Library | 90 | As is | 928 mg |
| P-611586358 | Toronto Research | In stock | 90 | As is | in stock |
| P-886618076 | A2B Chem | Predominantly Building Block in stock | 95 | As a main component | in stock |
| P-889929760 | AA Blocks | AA Blocks - synthesis | N/A | As a main component | by synthesis |
| P-595217426 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
| P-584607006 | Alinda | Building Blocks | 95 | As a main component | in stock |
| P-851670726 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-864215771 | AstaTech | Backordered BBs | 95 | As a main component | by synthesis |
| P-591091296 | BLD pharm | Non-stock building blocks | 97 | As a main component | by synthesis |
| P-619931858 | ChemDiv | Building Blocks on demand | 90 | As a main component | by synthesis |
| P-868624766 | Combi-Blocks | Building Block in stock | 96 | As a main component | in stock |
| P-580439680 | Debye Scientific | General Catalog | 95 | As a main component | by resynthesis (? - ? days) |
| P-862021592 | FluoroChem | General BB | N/A | As a main component | in stock |
| P-579458323 | Key Organics | Building Blocks | 97 | As a main component | 250 mg |
| P-579458340 | Key Organics | Building Blocks | 95 | As a main component | 250 mg |
| P-852560871 | Matrix Scientific | All | N/A | As a main component | in stock |
| P-854951567 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 188.269 |
| logP | 1.4557 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 15.27 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 64.9017 |
| Atoms | 30 |
| Rings | 3 |
| Heavy atoms | 14 |
| Hydrogen atoms | 16 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
