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MCULE-5745069561
Compound
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- 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 | 36 USD | 92 | 15 working days | Get Quote |
| 5 mg | 67 USD | 92 | 15 working days | Get Quote |
| 10 mg | 78 USD | 92 | 18 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-5745069561.sdf |
| SMILES | MCULE-5745069561.smiles |
| Standard InChI | MCULE-5745069561.inchi |
| InChIKey | MCULE-5745069561.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867457756 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-615711481 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851543944 | AmBeed | On request | N/A | As is | by synthesis |
| P-596460117 | Asinex | General screening catalog | 90 | As is | 1000 mg |
| P-596498161 | Asinex | General bb catalog | 90 | As is | 1000 mg |
| P-590803081 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-3275995 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 100 mg |
| P-577173196 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
| P-488547585 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-13572784 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-852402775 | Matrix Scientific | All | N/A | As is | in stock |
| P-864016189 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-454366966 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-19169789 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-13195262 | Specs | Screening Compounds | 90 | As is | 714 mg |
| P-502333599 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-3247139 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 331 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 245.306 |
| logP | 2.5786 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 97.34 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 68.2724 |
| Atoms | 28 |
| Rings | 3 |
| Heavy atoms | 17 |
| Hydrogen atoms | 11 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| 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 |
