Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3898554900
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 | 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.
| Name | File |
|---|---|
| SDF | MCULE-3898554900.sdf |
| SMILES | MCULE-3898554900.smiles |
| Standard InChI | MCULE-3898554900.inchi |
| InChIKey | MCULE-3898554900.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886598120 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-869245856 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-34886883 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-436472782 | Alinda | Building Blocks | 95 | As is | in stock |
| P-851715180 | AmBeed | On request | N/A | As is | by synthesis |
| P-869992579 | Asinex | General screening catalog | 90 | As is | 1000 mg |
| P-889808902 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-591038773 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-454731360 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-577187674 | ChemDiv | Discovery Chemistry Library | 90 | As is | 8 mg |
| P-37764 | Chemical Block | Screening Library | 90 | As is | 281 mg |
| P-868633326 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-34800738 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-862069589 | FluoroChem | General BB | N/A | As is | in stock |
| P-855977263 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-31231494 | LaboTest | Screening Collection | 90 | As is | 200 mg |
| P-852532751 | Matrix Scientific | All | N/A | As is | in stock |
| P-854917822 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-19532555 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-33437068 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-873228654 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-888448449 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-855216139 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 239.096 |
| logP | 0.0106 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 40.62 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 62.07 |
| Atoms | 26 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 12 |
| Heteroatoms | 6 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
