Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6609243896
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 | 35 USD | 90 | 19 working days | Get Quote |
| 5 mg | 52 USD | 90 | 19 working days | Get Quote |
| 10 mg | 67 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-6609243896.sdf |
| SMILES | MCULE-6609243896.smiles |
| Standard InChI | MCULE-6609243896.inchi |
| InChIKey | MCULE-6609243896.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-860631292 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-869346599 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851700798 | AmBeed | On request | N/A | As is | by synthesis |
| P-454643971 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-889403601 | FluoroChem | General BB | N/A | As is | in stock |
| P-492222246 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-502596666 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-596592060 | Key Organics | Building Blocks | 90 | As is | 500 mg |
| P-14189630 | Life Chemicals | Screening Compounds | 90 | As is | 247 mg |
| P-35170553 | Maybridge | Screening Collection | 90 | As is | 1.032 kg |
| P-641669188 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
| P-12834820 | Otava | In-House Stock Library | 90 | As is | 1.687 g |
| P-492283463 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1.687 g |
| P-885518335 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-18938457 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-33803223 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
| P-502338505 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-855222183 | Toronto Research | In stock | 90 | As is | in stock |
| P-481416 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 2.167 g |
| P-464674211 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 2.167 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 251.235 |
| logP | 1.3561 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 6 |
| PSA | 84.86 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 64.6505 |
| Atoms | 31 |
| Rings | 1 |
| Heavy atoms | 18 |
| Hydrogen atoms | 13 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
