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MCULE-9127752886
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 | 302 USD | 90 | 25 working days | Get Quote |
| 5 mg | 368 USD | 90 | 25 working days | Get Quote |
| 10 mg | 376 USD | 97 | 24 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-9127752886.sdf |
| SMILES | MCULE-9127752886.smiles |
| Standard InChI | MCULE-9127752886.inchi |
| InChIKey | MCULE-9127752886.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-851594624 | AmBeed | On request | N/A | As is | by synthesis |
| P-596496356 | Asinex | General bb catalog | 90 | As is | 1000 mg |
| P-596446285 | Asinex | General screening catalog | 90 | As is | 1000 mg |
| P-590835929 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-895628585 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 179.219 |
| logP | 1.9125 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 68.01 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 52.5681 |
| Atoms | 26 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 13 |
| Heteroatoms | 4 |
| 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 |
