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UNKNOWN STEREO
MCULE-3672563677
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 | 28 USD | 95 | 7 working days | Get Quote |
| 5 mg | 28 USD | 95 | 7 working days | Get Quote |
| 10 mg | 28 USD | 95 | 7 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-3672563677.sdf |
| SMILES | MCULE-3672563677.smiles |
| Standard InChI | MCULE-3672563677.inchi |
| InChIKey | MCULE-3672563677.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867539275 | N/A | As is | in stock |
| P-875695416 | 98 | As is | in stock |
| P-615714260 | 95 | As is | by resynthesis (? - ? days) |
| P-1270284758 | 98 | As is | in stock |
| P-887310367 | N/A | As is | in stock |
| P-596981586 | 98 | As is | 5 g |
| P-864154425 | 95 | As is | in stock |
| P-893237330 | 95 | As is | in stock |
| P-675211340 | 95 | As is | in stock |
| P-500412792 | 97 | As is | by synthesis |
| P-869176117 | 95 | As is | in stock |
| P-892292450 | 95 | As is | unavailable |
| P-892235217 | 95 | As is | 194 mg |
| P-892326253 | 95 | As is | 164 mg |
| P-611356826 | 90 | As is | in stock |
| P-1271669235 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 416.635 |
| logP | 5.7938 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 38.69 |
| RO5 violations | 1 |
| RO3 violations | 2 |
| Refractivity | 122.0688 |
| Atoms | 74 |
| Rings | 6 |
| Heavy atoms | 30 |
| Hydrogen atoms | 44 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 12 |
| R/S chiral centers | 12 |
| 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 |
