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UNKNOWN STEREO
MCULE-3299098489
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 | 95 | 7 working days | Get Quote |
| 5 mg | 43 USD | N/A | 22 working days | Get Quote |
| 10 mg | 75 USD | N/A | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-3299098489.sdf |
| SMILES | MCULE-3299098489.smiles |
| Standard InChI | MCULE-3299098489.inchi |
| InChIKey | MCULE-3299098489.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867646403 | N/A | As is | in stock |
| P-875813162 | 99 | As is | in stock |
| P-1275159652 | 98 | As is | in stock |
| P-1275198578 | 98 | As is | in stock |
| P-1270372334 | 99 | As is | in stock |
| P-606944305 | N/A | As is | in stock |
| P-596969983 | 99 | As is | 4 g |
| P-864111819 | 98 | As is | in stock |
| P-868543623 | 99 | As is | in stock |
| P-901458508 | 95 | As is | by synthesis |
| P-860799586 | 98 | As is | in stock |
| P-675216221 | 95 | As is | in stock |
| P-500411772 | 98 | As is | by synthesis |
| P-869161945 | 95 | As is | 85 mg |
| P-892296876 | 95 | As is | 287 mg |
| P-888657337 | 95 | As is | 287 mg |
| P-611422296 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 521.654 |
| logP | 4.0886 |
| H-bond acceptors | 10 |
| H-bond donors | 2 |
| Rotatable bonds | 8 |
| PSA | 102.93 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 158.8939 |
| Atoms | 77 |
| Rings | 5 |
| Heavy atoms | 38 |
| Hydrogen atoms | 39 |
| 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 |
