Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9495505919-0
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 | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 21 USD | N/A | 10 working days | Get Quote |
| 10 mg | 21 USD | N/A | 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.
| Name | File |
|---|---|
| SDF | MCULE-9495505919-0.sdf |
| SMILES | MCULE-9495505919-0.smiles |
| Standard InChI | MCULE-9495505919-0.inchi |
| InChIKey | MCULE-9495505919-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-580266017 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-589653711 | Apollo Scientific | In Stock | 95 | As is | 134.9 g |
| P-864158196 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-901457433 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-901376493 | FluoroChem | In Stock BB | N/A | As is | 20 g |
| P-502528558 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-488550156 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-13778360 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-596602453 | Key Organics | Building Blocks | 95 | As is | 8.98 g |
| P-579616526 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-613282685 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-862532714 | Manchester Organics | Stock compounds | 96 | As is | 400 g |
| P-580472467 | Manchester Organics | Compounds on demand | 90 | As is | by synthesis |
| P-852510022 | Matrix Scientific | All | N/A | As is | in stock |
| P-904059677 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
| P-854690690 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
| P-619672474 | Molnova | Stock | 98 | As is | in stock |
| P-454368544 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-864675310 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
| P-500380273 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-885523851 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-23969327 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-594273689 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-869177205 | TargetMol | Natural Products | 95 | As is | in stock |
| P-892295295 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-892337693 | TargetMol | Screening Compounds - stock amount | 95 | As is | 209 mg |
| P-873223254 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-855027766 | Toronto Research | In stock | 90 | As is | in stock |
| P-2377785 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1000 mg |
| P-3227993 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1000 mg |
| P-615392371 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 132.114 |
| logP | 0.0242 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 63.6 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 29.2058 |
| Atoms | 17 |
| Rings | 0 |
| Heavy atoms | 9 |
| Hydrogen atoms | 8 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
