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UNKNOWN STEREO
MCULE-5951702297-0
Structure
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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 | 69 USD | 99 | 22 working days | Get Quote |
| 5 mg | 155 USD | 99 | 22 working days | Get Quote |
| 10 mg | 260 USD | 99 | 16 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-5951702297-0.sdf |
| SMILES | MCULE-5951702297-0.smiles |
| Standard InChI | MCULE-5951702297-0.inchi |
| InChIKey | MCULE-5951702297-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867549625 | 99 | As is | in stock |
| P-875706917 | 99 | As is | in stock |
| P-613851192 | 95 | As is | by resynthesis (? - ? days) |
| P-1270325982 | 99 | As is | in stock |
| P-893291348 | N/A | As is | in stock |
| P-865905201 | 99 | As is | 100 mg |
| P-896023646 | 98 | As is | in stock |
| P-675218708 | 95 | As is | in stock |
| P-869177078 | 95 | As is | in stock |
| P-892294682 | 95 | As is | unavailable |
| P-892251522 | 95 | As is | 199 mg |
| P-892336738 | 95 | As is | 196 mg |
| P-1271683545 | 99 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 448.375 |
| logP | -0.2445 |
| H-bond acceptors | 11 |
| H-bond donors | 7 |
| Rotatable bonds | 4 |
| PSA | 190.28 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 108.1342 |
| Atoms | 52 |
| Rings | 4 |
| Heavy atoms | 32 |
| Hydrogen atoms | 20 |
| Heteroatoms | 11 |
| N/O atoms | 11 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 5 |
| R/S chiral centers | 5 |
| 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 |
