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MCULE-2592987512-0
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 | 36 USD | 95 | 10 working days | Get Quote |
| 5 mg | 36 USD | 95 | 10 working days | Get Quote |
| 10 mg | 36 USD | 95 | 10 working days | Get Quote |
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1
MCULE-7776957407-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2592987512-0.sdf |
| SMILES | MCULE-2592987512-0.smiles |
| Standard InChI | MCULE-2592987512-0.inchi |
| InChIKey | MCULE-2592987512-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-590417300 | 95 | As is | in stock |
| P-590967127 | 95 | As is | by synthesis |
| P-616227087 | 95 | As is | in stock |
| P-4149427 | 90 | As is | 100 mg |
| P-861376203 | 95 | As is | by synthesis |
| P-852417524 | N/A | As is | in stock |
| P-895641099 | 95 | As is | by synthesis |
| P-675100831 | 90 | As is | in stock |
| P-502385450 | 90 | As is | in stock |
| P-611451363 | 90 | As is | in stock |
| P-617782044 | 90 | As is | 2.565 g |
| P-617722675 | 90 | As is | 2.565 g |
| P-867614910 | 95 | Main component | in stock |
| P-867494399 | N/A | Main component | by synthesis |
| P-875775636 | N/A | Main component | in stock |
| P-855947802 | 95 | Main component | 5 g |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 229.744 |
| logP | 4.3875 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 35.25 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 66.8004 |
| Atoms | 35 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 20 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
