Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9789281340
Compound
Show structure
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 | 33 USD | 90 | 19 working days | Get Quote |
| 5 mg | 49 USD | 90 | 19 working days | Get Quote |
| 10 mg | 63 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.
| Name | File |
|---|---|
| SDF | MCULE-9789281340.sdf |
| SMILES | MCULE-9789281340.smiles |
| Standard InChI | MCULE-9789281340.inchi |
| InChIKey | MCULE-9789281340.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886853138 | A2B Chem | Predominantly Building Block in stock | 99 | As is | in stock |
| P-890194210 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-878260774 | AmBeed | In stock | N/A | As is | in stock |
| P-888836879 | Angene | Building Blocks in stock | 98 | As is | 1.96 g |
| P-889788817 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-878234539 | BLD pharm | In-stock building blocks | 98 | As is | 1.288 g |
| P-5591990 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 5 mg |
| P-674232952 | ChemDiv | Discovery Chemistry Library | 90 | As is | 25 mg |
| P-889730210 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-34581579 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-12643444 | InterBioScreen | Screening Compounds | 92 | As is | unavailable |
| P-899783174 | Key Organics | Building Blocks | 95 | As is | 1 mg |
| P-895185140 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-18968277 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-892272971 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892349794 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-22743817 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-599382 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 261 mg |
| P-886911793 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 391.419 |
| logP | 4.0512 |
| H-bond acceptors | 7 |
| H-bond donors | 2 |
| Rotatable bonds | 7 |
| PSA | 89.64 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 110.9345 |
| Atoms | 50 |
| Rings | 4 |
| Heavy atoms | 29 |
| Hydrogen atoms | 21 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| 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 |
