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UNKNOWN STEREO
MCULE-4799534908
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 | 17 USD | 98 | 22 working days | Get Quote |
| 5 mg | 48 USD | 98 | 20 working days | Get Quote |
| 10 mg | 76 USD | 98 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4799534908.sdf |
| SMILES | MCULE-4799534908.smiles |
| Standard InChI | MCULE-4799534908.inchi |
| InChIKey | MCULE-4799534908.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867620509 | 98 | As is | in stock |
| P-875782419 | 98 | As is | in stock |
| P-590399306 | 97 | As is | by resynthesis (? - ? days) |
| P-1270282362 | 98 | As is | in stock |
| P-606934176 | N/A | As is | in stock |
| P-619157243 | 98 | As is | 500 mg |
| P-889549462 | 98 | As is | in stock |
| P-675218817 | 95 | As is | in stock |
| P-869177456 | 95 | As is | in stock |
| P-892295503 | 95 | As is | unavailable |
| P-892252977 | 95 | As is | 103 mg |
| P-892337916 | 95 | As is | 103 mg |
| P-855348577 | 90 | As is | in stock |
| P-1271705774 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 374.426 |
| logP | 3.6474 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 9 |
| PSA | 77.38 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 103.8018 |
| Atoms | 53 |
| Rings | 2 |
| Heavy atoms | 27 |
| Hydrogen atoms | 26 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
