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UNKNOWN STEREO
MCULE-6485741081
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 | 25 USD | 98 | 20 working days | Get Quote |
| 5 mg | 37 USD | 95 | 7 working days | Get Quote |
| 10 mg | 59 USD | 95 | 7 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-6485741081.sdf |
| SMILES | MCULE-6485741081.smiles |
| Standard InChI | MCULE-6485741081.inchi |
| InChIKey | MCULE-6485741081.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867622486 | 98 | As is | in stock |
| P-875784796 | N/A | As is | in stock |
| P-869207175 | 95 | As is | in stock |
| P-606938001 | N/A | As is | in stock |
| P-596964712 | 98 | As is | 1.25 g |
| P-864148412 | 95 | As is | in stock |
| P-893267330 | 95 | As is | by synthesis |
| P-675214128 | 95 | As is | in stock |
| P-594274438 | 95 | As is | by synthesis |
| P-892295955 | 95 | As is | unavailable |
| P-888656859 | 95 | As is | 58 mg |
| P-855059472 | 90 | As is | in stock |
| P-855060699 | 90 | As is | in stock |
| P-868495753 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 528.563 |
| logP | 4.212 |
| H-bond acceptors | 10 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 125.13 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 152.2536 |
| Atoms | 64 |
| Rings | 6 |
| Heavy atoms | 40 |
| Hydrogen atoms | 24 |
| Heteroatoms | 10 |
| N/O atoms | 10 |
| 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 |
