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MCULE-5865599117
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 | 53 USD | 95 | 20 working days | Get Quote |
| 5 mg | 53 USD | 95 | 20 working days | Get Quote |
| 10 mg | 53 USD | 95 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-5865599117.sdf |
| SMILES | MCULE-5865599117.smiles |
| Standard InChI | MCULE-5865599117.inchi |
| InChIKey | MCULE-5865599117.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-872835045 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875828741 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869284980 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-868963292 | AmBeed | In stock | N/A | As is | in stock |
| P-489212869 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-881109154 | Angene | Building Blocks in stock | 95 | As is | 8 g |
| P-889554908 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580720239 | BLD pharm | In-stock building blocks | 95 | As is | 6.9 g |
| P-871217764 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868630560 | Combi-Blocks | Building Block in stock | 96 | As is | in stock |
| P-862113506 | FluoroChem | General BB | N/A | As is | in stock |
| P-524201473 | Key Organics | Building Blocks | 95 | As is | 100 mg |
| P-596547037 | Key Organics | Screening Compounds and Fragments | 95 | As is | 100 mg |
| P-590420492 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 188.186 |
| logP | 1.5924 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 94.89 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 52.0373 |
| Atoms | 22 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 8 |
| Heteroatoms | 5 |
| 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 |
