Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5924484630-0
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 | 39 USD | 90 | 19 working days | Get Quote |
| 5 mg | 57 USD | 90 | 19 working days | Get Quote |
| 10 mg | 72 USD | 90 | 19 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-7643203549-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5924484630-0.sdf |
| SMILES | MCULE-5924484630-0.smiles |
| Standard InChI | MCULE-5924484630-0.inchi |
| InChIKey | MCULE-5924484630-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-617766539 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 128 mg |
| P-612939888 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-851444277 | AmBeed | On request | N/A | Main component | by synthesis |
| P-596317952 | Asinex | General screening catalog | 90 | Main component | 1000 mg |
| P-596488000 | Asinex | General bb catalog | 90 | Main component | 1000 mg |
| P-591152489 | BLD pharm | Non-stock building blocks | 95 | Main component | by synthesis |
| P-492267749 | ChemBridge | Building Block Library | 95 | Main component | in stock |
| P-4635554 | ChemBridge | EXPRESS-Pick Collection | 90 | Main component | 5 mg |
| P-577167443 | ChemDiv | Building Blocks on demand | 90 | Main component | by synthesis |
| P-868568299 | Combi-Blocks | Building Block in stock | 95 | Main component | in stock |
| P-502496719 | Innovapharm | Virtual Building Blocks | 95 | Main component | by synthesis |
| P-852386011 | Matrix Scientific | All | N/A | Main component | in stock |
| P-453921255 | Specs | Screening Compounds | 90 | Main component | 220 mg |
| P-873236654 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-33519548 | TimTec | ActiMol 4 Week - On demand | 94 | Main component | by resynthesis (? - ? days) |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 241.716 |
| logP | 2.5406 |
| H-bond acceptors | 4 |
| H-bond donors | 3 |
| Rotatable bonds | 4 |
| PSA | 60.94 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 68.1062 |
| Atoms | 32 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 16 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| 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 |
