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UNKNOWN STEREO
MCULE-5644278357
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 | 65 USD | 95 | 22 working days | Get Quote |
| 5 mg | 189 USD | 95 | 16 working days | Get Quote |
| 10 mg | 254 USD | 95 | 16 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-5644278357.sdf |
| SMILES | MCULE-5644278357.smiles |
| Standard InChI | MCULE-5644278357.inchi |
| InChIKey | MCULE-5644278357.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867567983 | 95 | As is | in stock |
| P-875727891 | 95 | As is | in stock |
| P-892794577 | 95 | As is | by resynthesis (? - ? days) |
| P-606944807 | N/A | As is | in stock |
| P-596948073 | 95 | As is | 125 mg |
| P-872868238 | 99 | As is | in stock |
| P-901506767 | 95 | As is | by synthesis |
| P-860798423 | 98 | As is | in stock |
| P-580451935 | 99 | As is | in stock |
| P-505546294 | 95 | As is | in stock |
| P-892297066 | 95 | As is | unavailable |
| P-869162080 | 95 | As is | 53 mg |
| P-888657471 | 95 | As is | 53 mg |
| P-854991090 | 90 | As is | in stock |
| P-1271680666 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 721.861 |
| logP | 9.087 |
| H-bond acceptors | 10 |
| H-bond donors | 4 |
| Rotatable bonds | 18 |
| PSA | 168.45 |
| RO5 violations | 2 |
| RO3 violations | 6 |
| Refractivity | 200.3677 |
| Atoms | 95 |
| Rings | 6 |
| Heavy atoms | 52 |
| Hydrogen atoms | 43 |
| Heteroatoms | 11 |
| N/O atoms | 10 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 3 |
| 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 |
