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MCULE-7858118731
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 | 13 USD | 98 | 11 working days | Get Quote |
| 5 mg | 13 USD | 98 | 11 working days | Get Quote |
| 10 mg | 13 USD | 98 | 11 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-7858118731.sdf |
| SMILES | MCULE-7858118731.smiles |
| Standard InChI | MCULE-7858118731.inchi |
| InChIKey | MCULE-7858118731.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1264048580 | 95 | As is | in stock |
| P-1264059342 | 95 | As is | in stock |
| P-893571054 | 90 | As is | 74.858 g |
| P-489185385 | 97 | As is | in stock |
| P-25955339 | 85 | As is | 100 mg |
| P-860056000 | 98 | As is | by synthesis |
| P-505577203 | 98 | As is | in stock |
| P-452651169 | 98 | As is | in stock |
| P-579614384 | 98 | As is | 5 kg |
| P-852454589 | N/A | As is | in stock |
| P-905144790 | 95 | As is | in stock |
| P-854691892 | 95 | As is | in stock |
| P-474022519 | 95 | As is | in stock |
| P-608276429 | 98 | As is | in stock |
| P-1263956469 | 90 | As is | in stock |
| P-617401702 | N/A | As is | in stock |
| P-873285290 | N/A | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 399.436 |
| logP | 3.2625 |
| H-bond acceptors | 7 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 83.09 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 109.3567 |
| Atoms | 54 |
| Rings | 3 |
| Heavy atoms | 29 |
| Hydrogen atoms | 25 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
