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MCULE-6354801445
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 | 37 USD | 95 | 12 working days | Get Quote |
| 5 mg | 85 USD | 95 | 12 working days | Get Quote |
| 10 mg | 149 USD | 95 | 12 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-6354801445.sdf |
| SMILES | MCULE-6354801445.smiles |
| Standard InChI | MCULE-6354801445.inchi |
| InChIKey | MCULE-6354801445.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867571076 | 98 | As is | in stock |
| P-875730872 | 98 | As is | in stock |
| P-595215683 | 98 | As is | by resynthesis (? - ? days) |
| P-903060117 | 98 | As is | 8.3 g |
| P-895094639 | 98 | As is | 208.7 g |
| P-1273288576 | 95 | As is | by resynthesis (? - ? days) |
| P-1268703043 | 95 | As is | in stock |
| P-901519213 | 95 | As is | by synthesis |
| P-608495805 | 95 | As is | in stock |
| P-1275598743 | 95 | As is | by synthesis |
| P-854712788 | 95 | As is | in stock |
| P-871066130 | 95 | As is | in stock |
| P-1274332631 | 95 | As is | unavailable |
| P-869118338 | 95 | As is | 957 mg |
| P-888633405 | 95 | As is | 947 mg |
| P-855065805 | 90 | As is | in stock |
| P-868503663 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 623.833 |
| logP | 6.0318 |
| H-bond acceptors | 9 |
| H-bond donors | 2 |
| Rotatable bonds | 13 |
| PSA | 157.41 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 180.6384 |
| Atoms | 84 |
| Rings | 4 |
| Heavy atoms | 43 |
| Hydrogen atoms | 41 |
| Heteroatoms | 11 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
