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MCULE-3990535937-0
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 | 524 USD | 98 | 11 working days | Get Quote |
| 5 mg | 524 USD | 98 | 11 working days | Get Quote |
| 10 mg | 1049 USD | 98 | 11 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-3990535937-0.sdf |
| SMILES | MCULE-3990535937-0.smiles |
| Standard InChI | MCULE-3990535937-0.inchi |
| InChIKey | MCULE-3990535937-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-853437390 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851455124 | AmBeed | On request | N/A | As is | by synthesis |
| P-590777662 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-452654422 | Chemfaces | Natural Compounds | 98 | As is | in stock |
| P-878210898 | Key Organics | Building Blocks | 95 | As is | 5 mg |
| P-874452687 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
| P-892307235 | TargetMol | Natural Products | 95 | As is | in stock |
| P-869170038 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-888662719 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 374.341 |
| logP | 3.252 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 108.74 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 101.458 |
| Atoms | 42 |
| Rings | 4 |
| Heavy atoms | 28 |
| Hydrogen atoms | 14 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| 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 |
