Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8681339154
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 | 5 USD | 95 | 8 working days | Get Quote |
| 5 mg | 5 USD | 95 | 8 working days | Get Quote |
| 10 mg | 5 USD | 95 | 8 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-8681339154.sdf |
| SMILES | MCULE-8681339154.smiles |
| Standard InChI | MCULE-8681339154.inchi |
| InChIKey | MCULE-8681339154.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867559043 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875718605 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-595218334 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-903047155 | Aaron Chemicals LLC | Predominantly Building Block | 99 | As is | 8 kg |
| P-19881347 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-606869506 | AmBeed | In stock | N/A | As is | in stock |
| P-596944534 | Angene | Building Blocks in stock | 95 | As is | 5 kg |
| P-895920332 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-895931367 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864164647 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580705533 | BLD pharm | In-stock building blocks | 95 | As is | 1.78 kg |
| P-851273942 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868611489 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-34597406 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-580415604 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-901375130 | FluoroChem | In Stock BB | N/A | As is | 100 g |
| P-579636045 | LabSeeker, Inc | On demand Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-428089370 | Maybridge | Screening Collection | 90 | As is | 6.705 kg |
| P-869093451 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-885542096 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502326574 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22469206 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 1000 mg |
| P-588839769 | VITAS M CHEMICAL LIMITED | Virtual synthesis library | N/A | As is | by synthesis |
| P-575315601 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 192.254 |
| logP | 2.7707 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 26.3 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 56.9915 |
| Atoms | 30 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 16 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
