Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9792551388-1
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 | 7 USD | 98 | 20 working days | Get Quote |
| 5 mg | 7 USD | 98 | 20 working days | Get Quote |
| 10 mg | 7 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.
-
MCULE-2780567509-0
- Component type: Main
-
MCULE-7884944577-0
- Component type: Main
-
MCULE-3552661198-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-9792551388-1.sdf |
| SMILES | MCULE-9792551388-1.smiles |
| Standard InChI | MCULE-9792551388-1.inchi |
| InChIKey | MCULE-9792551388-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875785507 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-535622536 | AK Scientific | Building Blocks | 98 | As a main component | in stock |
| P-881670381 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
| P-606878328 | AmBeed | In stock | N/A | As a main component | in stock |
| P-489238321 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As a main component | in stock |
| P-596964791 | Angene | Building Blocks in stock | 98 | As a main component | 19.347 kg |
| P-584628272 | BLD pharm | In-stock building blocks | 98 | As a main component | 2.725 kg |
| P-868613744 | Combi-Blocks | Building Block in stock | 98 | As a main component | in stock |
| P-862145390 | FluoroChem | General BB | N/A | As a main component | in stock |
| P-596562879 | Key Organics | Building Blocks | 97 | As a main component | 500 g |
| P-856081870 | LabSeeker, Inc | On demand Catalog | 95 | As a main component | by resynthesis (? - ? days) |
| P-855240867 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-666976386 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 75.043 |
| logP | -2.2714 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 60.36 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 12.7193 |
| Atoms | 8 |
| Rings | 0 |
| Heavy atoms | 5 |
| Hydrogen atoms | 3 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
