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MCULE-4736676081
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 | 84 USD | N/A | 17 working days | Get Quote |
| 5 mg | 84 USD | N/A | 17 working days | Get Quote |
| 10 mg | 84 USD | N/A | 17 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-4736676081.sdf |
| SMILES | MCULE-4736676081.smiles |
| Standard InChI | MCULE-4736676081.inchi |
| InChIKey | MCULE-4736676081.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886661058 | 95 | As is | in stock |
| P-889963949 | N/A | As is | by synthesis |
| P-869278104 | 95 | As is | in stock |
| P-903226825 | 95 | As is | 2.5 g |
| P-851721514 | N/A | As is | by synthesis |
| P-889812295 | 95 | As is | by synthesis |
| P-611118724 | 95 | As is | by synthesis |
| P-901551150 | 95 | As is | by synthesis |
| P-861399780 | 95 | As is | by synthesis |
| P-895490764 | 95 | As is | by synthesis |
| P-657743270 | 90 | As is | by synthesis |
| P-611550082 | 90 | As is | in stock |
| P-893759619 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 257.233 |
| logP | 2.1947 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 66.4 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 60.354 |
| Atoms | 31 |
| Rings | 1 |
| Heavy atoms | 18 |
| Hydrogen atoms | 13 |
| Heteroatoms | 6 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
