Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3767425189
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 | 20 working days | Get Quote |
| 5 mg | 10 USD | 98 | 20 working days | Get Quote |
| 10 mg | 10 USD | 98 | 20 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-3767425189.sdf |
| SMILES | MCULE-3767425189.smiles |
| Standard InChI | MCULE-3767425189.inchi |
| InChIKey | MCULE-3767425189.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875830244 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590373859 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893578960 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 820 g |
| P-606851014 | AmBeed | In stock | N/A | As is | in stock |
| P-489120746 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-619164646 | Angene | Building Blocks in stock | 98 | As is | 400 g |
| P-895921804 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864096208 | AstaTech | In Stock BBs | 98 | As is | in stock |
| P-615697577 | BLD pharm | In-stock building blocks | 98 | As is | 15.25 g |
| P-893226884 | Biosynth | In Stock | 95 | As is | in stock |
| P-868622508 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-862029975 | FluoroChem | General BB | N/A | As is | in stock |
| P-870655367 | Glentham Life Sciences | Compounds typically in stock | 98 | As is | in stock |
| P-870658067 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-505493408 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-454416133 | Key Organics | Building Blocks | 95 | As is | 578 mg |
| P-855931926 | Key Organics | Building Blocks | 95 | As is | 5 g |
| P-454407262 | Key Organics | Building Blocks | 95 | As is | 67 mg |
| P-563474399 | Key Organics | Building Blocks | 97 | As is | 1000 mg |
| P-454329604 | Key Organics | Screening Compounds and Fragments | 95 | As is | 67 mg |
| P-454349518 | Key Organics | Screening Compounds and Fragments | 95 | As is | 578 mg |
| P-856089656 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-31161070 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-872526840 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-500380756 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-868129766 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885546720 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-22525316 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 10 mg |
| P-893947104 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-480865314 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-615423328 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 212.290 |
| logP | 3.787 |
| H-bond acceptors | 2 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 52.04 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 66.1168 |
| Atoms | 32 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 16 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 2 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
