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MCULE-9539918655
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 | 36 USD | 98 | 27 working days | Get Quote |
| 5 mg | 36 USD | 98 | 27 working days | Get Quote |
| 10 mg | 36 USD | 98 | 27 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9539918655.sdf |
| SMILES | MCULE-9539918655.smiles |
| Standard InChI | MCULE-9539918655.inchi |
| InChIKey | MCULE-9539918655.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-852132410 | 90 | As is | by synthesis |
| P-852145946 | 98 | As is | by synthesis |
| P-869360453 | 95 | As is | in stock |
| P-851468904 | N/A | As is | by synthesis |
| P-1263694640 | N/A | As is | in stock |
| P-889849355 | 95 | As is | by synthesis |
| P-502564185 | 95 | As is | by synthesis |
| P-504186086 | 90 | As is | by synthesis |
| P-502669719 | 90 | As is | in stock |
| P-13210053 | 92 | As is | unavailable |
| P-18816858 | 90 | As is | 3.028 g |
| P-454405946 | 90 | As is | 3.028 g |
| P-424808124 | 90 | As is | in stock |
| P-453919901 | 90 | As is | 60 mg |
| P-869127236 | 95 | As is | by synthesis |
| P-888640396 | 95 | As is | unavailable |
| P-23321264 | 90 | As is | in stock |
| P-907223790 | 94 | As is | by resynthesis (? - ? days) |
| P-906892486 | 98 | As is | by synthesis |
| P-25599467 | 90 | As is | 123 mg |
| P-894002759 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 221.234 |
| logP | 2.0449 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 91.7 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 61.1527 |
| Atoms | 22 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 7 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
