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MCULE-5854471101
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 | 30 USD | 98 | 16 working days | Get Quote |
| 5 mg | 69 USD | 98 | 16 working days | Get Quote |
| 10 mg | 114 USD | 98 | 16 working days | Get Quote |
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MCULE-1583772518
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5854471101.sdf |
| SMILES | MCULE-5854471101.smiles |
| Standard InChI | MCULE-5854471101.inchi |
| InChIKey | MCULE-5854471101.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903120080 | 99 | As is | 8 mg |
| P-1264047976 | 95 | As is | in stock |
| P-893482106 | 90 | As is | 1.117 g |
| P-890237288 | 99 | As is | 38 mg |
| P-851268648 | 95 | As is | by synthesis |
| P-1263259036 | 95 | As is | by synthesis |
| P-579479469 | 95 | As is | in stock |
| P-895181594 | 95 | As is | in stock |
| P-584621803 | 95 | As is | in stock |
| P-608271771 | 98 | As is | in stock |
| P-579712304 | N/A | As is | in stock |
| P-589631461 | N/A | As is | in stock |
| P-903310042 | 98 | As a main component | 100 mg |
| P-1264055513 | 95 | As a main component | in stock |
| P-893584659 | 90 | As a main component | 2.879 g |
| P-892413135 | 99 | As a main component | 87 mg |
| P-871212463 | 95 | As a main component | by synthesis |
| P-893630621 | 95 | As a main component | by synthesis |
| P-900266180 | 95 | As a main component | in stock |
| P-854715953 | 95 | As a main component | in stock |
| P-871071934 | 95 | As a main component | in stock |
| P-878643340 | 98 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 669.804 |
| logP | 6.433 |
| H-bond acceptors | 11 |
| H-bond donors | 7 |
| Rotatable bonds | 21 |
| PSA | 178.3 |
| RO5 violations | 4 |
| RO3 violations | 6 |
| Refractivity | 180.6336 |
| Atoms | 97 |
| Rings | 3 |
| Heavy atoms | 48 |
| Hydrogen atoms | 49 |
| Heteroatoms | 13 |
| N/O atoms | 11 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 1 |
