Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5066641285
Compound
Show structures
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 | 90 | 17 working days | Get Quote |
| 5 mg | 35 USD | 90 | 17 working days | Get Quote |
| 10 mg | 41 USD | 90 | 17 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-9431050984
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5066641285.sdf |
| SMILES | MCULE-5066641285.smiles |
| Standard InChI | MCULE-5066641285.inchi |
| InChIKey | MCULE-5066641285.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-517103366 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-851885335 | AmBeed | On request | N/A | As is | by synthesis |
| P-591037237 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-12404994 | InterBioScreen | Screening Compounds | 92 | As is | 105 mg |
| P-895830791 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-19021549 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-491305266 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-873229200 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-33182279 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 200 mg |
| P-24170726 | InterBioScreen | Screening Compounds | 92 | As a main component | 300 mg |
| P-13279984 | Pharmeks LLC | Synthetic compounds | 92 | As a main component | 300 mg |
| P-675100496 | Princeton Biomolecular Research | Screening Compounds | 90 | As a main component | in stock |
| P-519909841 | Princeton Biomolecular Research | Screening Compounds | 90 | As a main component | in stock |
| P-2147657 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As a main component | 135 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 189.260 |
| logP | 1.8227 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 102.56 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 46.3303 |
| Atoms | 18 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 7 |
| Heteroatoms | 5 |
| 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 |
