Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4086792290
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 | 33 USD | 90 | 19 working days | Get Quote |
| 5 mg | 35 USD | 95 | 14 working days | Get Quote |
| 10 mg | 40 USD | 95 | 15 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-4086792290.sdf |
| SMILES | MCULE-4086792290.smiles |
| Standard InChI | MCULE-4086792290.inchi |
| InChIKey | MCULE-4086792290.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875806807 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-613856099 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-610992339 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 51.223 g |
| P-19948469 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-436455262 | Alinda | Building Blocks | 95 | As is | 2 g |
| P-606888863 | AmBeed | In stock | N/A | As is | in stock |
| P-489241691 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-865922084 | Angene | Building Blocks in stock | 95 | As is | 14.05 g |
| P-869390621 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-851146039 | BLD pharm | In-stock building blocks | 95 | As is | 4.915 g |
| P-454704051 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-851253839 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868634825 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-580758468 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-580390328 | Debye Scientific | General Catalog | N/A | As is | by resynthesis (? - ? days) |
| P-862027470 | FluoroChem | General BB | 95 | As is | in stock |
| P-596589469 | Key Organics | Building Blocks | 90 | As is | 1000 mg |
| P-588253693 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852409322 | Matrix Scientific | All | N/A | As is | in stock |
| P-900009809 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-23895496 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885524836 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-535714928 | Rieke Metals | Natural Compounds | N/A | As is | in stock |
| P-873285172 | Shanghai iChemical | In stock | N/A | As is | in stock |
| P-33300341 | TimTec | ActiMol 2 Week | 90 | As is | in stock |
| P-873220563 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-888577695 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-611593680 | Toronto Research | In stock | 90 | As is | in stock |
| P-3231394 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 981 mg |
| P-1411687 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 981 mg |
| P-893994005 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 200.617 |
| logP | 2.4369 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 46.53 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 49.7103 |
| Atoms | 22 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 9 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |
