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UNKNOWN STEREO
MCULE-4190866478
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 | 18 USD | N/A | 9 working days | Get Quote |
| 5 mg | 44 USD | N/A | 9 working days | Get Quote |
| 10 mg | 65 USD | N/A | 9 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-4190866478.sdf |
| SMILES | MCULE-4190866478.smiles |
| Standard InChI | MCULE-4190866478.inchi |
| InChIKey | MCULE-4190866478.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852178249 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-595222048 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-606942667 | AmBeed | In stock | N/A | As is | in stock |
| P-864154454 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-893237032 | Biosynth | In Stock | 95 | As is | in stock |
| P-448836031 | ChemDiv | Discovery Chemistry Library | 90 | As is | 452 mg |
| P-504191059 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-13944789 | InterBioScreen | Natural Compounds | 92 | As is | 300 mg |
| P-892250474 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-869177041 | TargetMol | Natural Products | 95 | As is | in stock |
| P-892294501 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-892336059 | TargetMol | Screening Compounds - stock amount | 95 | As is | 151 mg |
| P-502330618 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611603906 | Toronto Research | In stock | 90 | As is | in stock |
| P-3248386 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 165 mg |
| P-886937418 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 217.263 |
| logP | 1.3429 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 0 |
| PSA | 29.54 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 63.335 |
| Atoms | 31 |
| Rings | 4 |
| Heavy atoms | 16 |
| Hydrogen atoms | 15 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 3 |
| 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 |
