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UNKNOWN STEREO
MCULE-5054471913
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 | 48 USD | N/A | 9 working days | Get Quote |
| 5 mg | 97 USD | N/A | 17 working days | Get Quote |
| 10 mg | 147 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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1
MCULE-6531593680
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5054471913.sdf |
| SMILES | MCULE-5054471913.smiles |
| Standard InChI | MCULE-5054471913.inchi |
| InChIKey | MCULE-5054471913.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875711422 | N/A | As is | in stock |
| P-853434978 | 95 | As is | in stock |
| P-851750947 | N/A | As is | by synthesis |
| P-619185582 | 98 | As is | 15 mg |
| P-896035207 | 95 | As is | by synthesis |
| P-868545315 | 99 | As is | in stock |
| P-1263521103 | 95 | As is | by synthesis |
| P-886679927 | 95 | Main component | in stock |
| P-889981837 | N/A | Main component | by synthesis |
| P-904574178 | 95 | Main component | in stock |
| P-851782161 | N/A | Main component | by synthesis |
| P-869131589 | 95 | Main component | by synthesis |
| P-888642690 | 95 | Main component | unavailable |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 214.647 |
| logP | 1.8595 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 0 |
| PSA | 66.56 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 57.0379 |
| Atoms | 25 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 11 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
