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MCULE-3545643977-0
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 | 320 USD | 95 | 14 working days | Get Quote |
| 5 mg | 320 USD | 95 | 14 working days | Get Quote |
| 10 mg | 589 USD | 95 | 42 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-3545643977-0.sdf |
| SMILES | MCULE-3545643977-0.smiles |
| Standard InChI | MCULE-3545643977-0.inchi |
| InChIKey | MCULE-3545643977-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1266073104 | 98 | As is | in stock |
| P-1265798313 | 98 | As is | in stock |
| P-853444346 | 98 | As is | by resynthesis (? - ? days) |
| P-1264539703 | 98 | As is | 5 mg |
| P-851655055 | N/A | As is | by synthesis |
| P-864262584 | 95 | As is | by synthesis |
| P-901536374 | 95 | As is | by synthesis |
| P-580451425 | 98 | As is | in stock |
| P-1273111246 | 95 | As is | 100 mg |
| P-901577286 | 95 | As is | in stock |
| P-491319060 | 95 | As is | by synthesis |
| P-869158639 | 95 | As is | unavailable |
| P-888654400 | 95 | As is | unavailable |
| P-611464524 | 90 | As is | in stock |
| P-1271460272 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 428.329 |
| logP | 6.8458 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 67.53 |
| RO5 violations | 1 |
| RO3 violations | 4 |
| Refractivity | 115.2313 |
| Atoms | 43 |
| Rings | 4 |
| Heavy atoms | 28 |
| Hydrogen atoms | 15 |
| Heteroatoms | 6 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
