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UNKNOWN STEREO
MCULE-3514254258-0
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 | 7 USD | 90 | 20 working days | Get Quote |
| 5 mg | 7 USD | 90 | 20 working days | Get Quote |
| 10 mg | 7 USD | 90 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-3514254258-0.sdf |
| SMILES | MCULE-3514254258-0.smiles |
| Standard InChI | MCULE-3514254258-0.inchi |
| InChIKey | MCULE-3514254258-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867659122 | 98 | As is | in stock |
| P-875827271 | N/A | As is | in stock |
| P-851928573 | N/A | As is | in stock |
| P-865926005 | 90 | As is | 1000 g |
| P-901337563 | 95 | As is | by synthesis |
| P-1263577850 | 95 | As is | by synthesis |
| P-428624417 | 90 | As is | in stock |
| P-492272669 | 95 | As is | 3.74 g |
| P-505492203 | 95 | As is | in stock |
| P-580039723 | 90 | As is | in stock |
| P-492245533 | 95 | As is | in stock |
| P-488556197 | 92 | As is | in stock |
| P-488544909 | 90 | As is | in stock |
| P-620218912 | 95 | As is | 3.74 g |
| P-674817272 | 90 | As is | 3.74 g |
| P-454365181 | 92 | As is | in stock |
| P-500374228 | N/A | As is | by synthesis |
| P-892235775 | 95 | As is | by synthesis |
| P-892302774 | 95 | As is | in stock |
| P-892292540 | 95 | As is | 1.191 g |
| P-892326619 | 95 | As is | 1.191 g |
| P-886937295 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 446.360 |
| logP | 0.1422 |
| H-bond acceptors | 11 |
| H-bond donors | 6 |
| Rotatable bonds | 4 |
| PSA | 187.12 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 106.7212 |
| Atoms | 50 |
| Rings | 4 |
| Heavy atoms | 32 |
| Hydrogen atoms | 18 |
| Heteroatoms | 11 |
| N/O atoms | 11 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 5 |
| R/S chiral centers | 5 |
| 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 |
