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MCULE-8698434024-1
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 | 13 USD | 99 | 22 working days | Get Quote |
| 5 mg | 23 USD | 99 | 22 working days | Get Quote |
| 10 mg | 32 USD | 99 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-8698434024-1.sdf |
| SMILES | MCULE-8698434024-1.smiles |
| Standard InChI | MCULE-8698434024-1.inchi |
| InChIKey | MCULE-8698434024-1.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867678477 | 99 | As is | in stock |
| P-875855874 | 99 | As is | in stock |
| P-903300477 | 98 | As is | 2 g |
| P-865931871 | 98 | As is | 1000 mg |
| P-1273267124 | 95 | As is | by resynthesis (? - ? days) |
| P-579481474 | 95 | As is | in stock |
| P-873246097 | 97 | As is | 1 mg |
| P-904641424 | 95 | As is | by synthesis |
| P-854718550 | 95 | As is | in stock |
| P-892293500 | 95 | As is | unavailable |
| P-611504430 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 395.761 |
| logP | 3.4548 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 63.58 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 99.8407 |
| Atoms | 40 |
| Rings | 3 |
| Heavy atoms | 27 |
| Hydrogen atoms | 13 |
| Heteroatoms | 9 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 4 |
| 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 |
