Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3732906303-0
Structure
Show compound
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 | 35 USD | 95 | 10 working days | Get Quote |
| 5 mg | 35 USD | 95 | 10 working days | Get Quote |
| 10 mg | 35 USD | 95 | 10 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.
-
1
MCULE-4468193962-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3732906303-0.sdf |
| SMILES | MCULE-3732906303-0.smiles |
| Standard InChI | MCULE-3732906303-0.inchi |
| InChIKey | MCULE-3732906303-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867619561 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875780850 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-894647382 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851855106 | AmBeed | On request | N/A | As is | by synthesis |
| P-864327202 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-611162946 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-616227836 | ChemBridge | Building Block Library | 95 | As is | in stock |
| P-4157899 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 50 mg |
| P-861376768 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-862059378 | FluoroChem | General BB | 95 | As is | in stock |
| P-855948008 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-854936054 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-611394058 | Toronto Research | In stock | 90 | As is | in stock |
| P-893666849 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| P-612875390 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
| P-869292063 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-851699786 | AmBeed | On request | N/A | Main component | by synthesis |
| P-489197638 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component | in stock |
| P-590973059 | BLD pharm | Non-stock building blocks | 95 | Main component | by synthesis |
| P-861483971 | Combi-Blocks | Building Block on demand | 97 | Main component | by synthesis |
| P-580428489 | Debye Scientific | General Catalog | 95 | Main component | by resynthesis (? - ? days) |
| P-854952163 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-855359732 | Toronto Research | In stock | 90 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 205.680 |
| logP | 1.6853 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 40.54 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 56.6968 |
| Atoms | 29 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 16 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
