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MCULE-1330867514-0
Structure
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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 | 33 USD | 90 | 19 working days | Get Quote |
| 5 mg | 49 USD | 90 | 19 working days | Get Quote |
| 10 mg | 63 USD | 90 | 19 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-1330867514-0.sdf |
| SMILES | MCULE-1330867514-0.smiles |
| Standard InChI | MCULE-1330867514-0.inchi |
| InChIKey | MCULE-1330867514-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852084922 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-875770772 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590355765 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851629425 | AmBeed | On request | N/A | As is | by synthesis |
| P-851821090 | AmBeed | On request | N/A | As is | by synthesis |
| P-869991693 | Asinex | General screening catalog | 90 | As is | 1000 mg |
| P-596516688 | Asinex | General bb catalog | 90 | As is | 1000 mg |
| P-864213292 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-590856864 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-591003013 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-427957693 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 5 mg |
| P-580340134 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-502472785 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-563470562 | Key Organics | Building Blocks | 95 | As is | 250 mg |
| P-588253276 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852382175 | Matrix Scientific | All | N/A | As is | in stock |
| P-854921778 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-18970599 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885517313 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502340421 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-873037533 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 3 mg |
| P-608595 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.922 g |
| P-3218799 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.922 g |
| P-3240886 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 1.922 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 221.281 |
| logP | 2.5889 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 89.27 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 60.2584 |
| Atoms | 26 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 11 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| 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 |
