Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9375458895-0
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 | 5 USD | 98 | 8 working days | Get Quote |
| 5 mg | 5 USD | 98 | 8 working days | Get Quote |
| 10 mg | 5 USD | 98 | 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-9375458895-0.sdf |
| SMILES | MCULE-9375458895-0.smiles |
| Standard InChI | MCULE-9375458895-0.inchi |
| InChIKey | MCULE-9375458895-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867558960 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875718805 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-436474127 | Alinda | Building Blocks | 95 | As is | in stock |
| P-34884548 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-606900649 | AmBeed | In stock | N/A | As is | in stock |
| P-489229448 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-597009980 | Angene | Building Blocks in stock | 98 | As is | 200 g |
| P-864203317 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-674400519 | BLD pharm | In-stock building blocks | 98 | As is | 161 g |
| P-893235056 | Biosynth | In Stock | 95 | As is | in stock |
| P-454735202 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-893621303 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-580273823 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-862070445 | FluoroChem | General BB | N/A | As is | in stock |
| P-502446063 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-503006893 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-502591789 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-14055347 | Life Chemicals | Building Blocks | 95 | As is | 403 mg |
| P-601068918 | Life Chemicals | Screening Compounds | 90 | As is | 403 mg |
| P-852506514 | Matrix Scientific | All | N/A | As is | in stock |
| P-888752400 | Otava | In-House Stock Library | 90 | As is | 100 mg |
| P-889885573 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-505617636 | Ramidus | In stock compounds | 95 | As is | in stock |
| P-502329887 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-888438663 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-611365053 | Toronto Research | In stock | 90 | As is | in stock |
| P-901168019 | XtalPi Inc. | Express Building Blocks | 98 | As is | in stock |
| P-615450192 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 224.170 |
| logP | 1.3233 |
| H-bond acceptors | 7 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 112.22 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 54.839 |
| Atoms | 24 |
| Rings | 1 |
| Heavy atoms | 16 |
| Hydrogen atoms | 8 |
| 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 |
