Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1575585247
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 | 13 USD | N/A | 35 working days | Get Quote |
| 5 mg | 13 USD | N/A | 35 working days | Get Quote |
| 10 mg | 13 USD | N/A | 35 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-1575585247.sdf |
| SMILES | MCULE-1575585247.smiles |
| Standard InChI | MCULE-1575585247.inchi |
| InChIKey | MCULE-1575585247.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867544272 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875701630 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-489218229 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-889479782 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-868618983 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-580296232 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-862022941 | FluoroChem | General BB | N/A | As is | in stock |
| P-494300173 | Frinton Laboratories | Frinton Building Blocks | 98 | As is | in stock |
| P-870659740 | Glentham Life Sciences | Compounds typically in stock | 96 | As is | in stock |
| P-488546813 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-13472829 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-867706478 | Manchester Organics | Compounds on demand | 98 | As is | by synthesis |
| P-852550537 | Matrix Scientific | All | N/A | As is | in stock |
| P-863738532 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
| P-620224702 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1000 mg |
| P-620070120 | Otava | In-House Stock Library | 90 | As is | 1000 mg |
| P-454370846 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-23796821 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
| P-519914458 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885528481 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502332293 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611409235 | Toronto Research | In stock | 90 | As is | in stock |
| P-855030356 | Toronto Research | In stock | 90 | As is | in stock |
| P-855030360 | Toronto Research | In stock | 90 | As is | in stock |
| P-464681255 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.015 g |
| P-1797360 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.015 g |
| P-666974933 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 206.323 |
| logP | 4.106 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 20.23 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 66.703 |
| Atoms | 37 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 22 |
| Heteroatoms | 1 |
| N/O atoms | 1 |
| 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 |
