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MCULE-1849097666
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 | 33 USD | 98 | 16 working days | Get Quote |
| 5 mg | 33 USD | 98 | 16 working days | Get Quote |
| 10 mg | 33 USD | 98 | 16 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-6147730661
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1849097666.sdf |
| SMILES | MCULE-1849097666.smiles |
| Standard InChI | MCULE-1849097666.inchi |
| InChIKey | MCULE-1849097666.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-489115072 | 97 | As is | in stock |
| P-907573864 | 95 | As is | by synthesis |
| P-895190442 | 95 | As is | by synthesis |
| P-903086429 | 98 | As a main component | 750 mg |
| P-893608245 | 90 | As a main component | 116.227 g |
| P-907572432 | 95 | As a main component | by synthesis |
| P-505578428 | 98 | As a main component | in stock |
| P-851278271 | 95 | As a main component | by synthesis |
| P-861433754 | 95 | As a main component | by synthesis |
| P-901409865 | 98 | As a main component | 500 mg |
| P-579628910 | 96 | As a main component | 5 g |
| P-896629482 | 95 | As a main component | by synthesis |
| P-854714685 | 95 | As a main component | in stock |
| P-608280279 | 98 | As a main component | in stock |
| P-579710648 | N/A | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 498.567 |
| logP | 2.9131 |
| H-bond acceptors | 9 |
| H-bond donors | 2 |
| Rotatable bonds | 13 |
| PSA | 114.4 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 137.4775 |
| Atoms | 70 |
| Rings | 3 |
| Heavy atoms | 36 |
| Hydrogen atoms | 34 |
| Heteroatoms | 9 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 3 |
| 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 |
