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UNKNOWN STEREO
MCULE-4915812221
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 | 325 USD | 98 | 23 working days | Get Quote |
| 5 mg | 325 USD | 98 | 23 working days | Get Quote |
| 10 mg | 325 USD | 98 | 23 working days | Get Quote |
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1
MCULE-6726420416
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4915812221.sdf |
| SMILES | MCULE-4915812221.smiles |
| Standard InChI | MCULE-4915812221.inchi |
| InChIKey | MCULE-4915812221.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867457010 | N/A | As is | by synthesis |
| P-901191534 | N/A | As is | by synthesis |
| P-595210464 | 95 | As is | in stock |
| P-851486293 | N/A | As is | by synthesis |
| P-580306520 | 95 | As is | by resynthesis (? - ? days) |
| P-505622242 | 98 | As is | in stock |
| P-893105857 | N/A | Main component | by synthesis |
| P-595210741 | 95 | Main component | in stock |
| P-851461768 | N/A | Main component | by synthesis |
| P-580306543 | 95 | Main component | by resynthesis (? - ? days) |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 276.155 |
| logP | 3.076 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 49.33 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 73.7925 |
| Atoms | 32 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 15 |
| Heteroatoms | 5 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
