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MCULE-1290044817
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 | 71 USD | 98 | 10 working days | Get Quote |
| 5 mg | 88 USD | 98 | 10 working days | Get Quote |
| 10 mg | 119 USD | 98 | 10 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1290044817.sdf |
| SMILES | MCULE-1290044817.smiles |
| Standard InChI | MCULE-1290044817.inchi |
| InChIKey | MCULE-1290044817.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867403972 | N/A | As is | by synthesis |
| P-907354810 | 90 | As is | 3 kg |
| P-851543408 | N/A | As is | by synthesis |
| P-619592758 | 98 | As is | by synthesis |
| P-901458652 | 95 | As is | by synthesis |
| P-851300246 | 95 | As is | by synthesis |
| P-870648753 | N/A | As is | in stock |
| P-856008038 | 98 | As is | 100 mg |
| P-856005674 | 98 | As is | 100 mg |
| P-524163264 | 98 | As is | 100 g |
| P-524199354 | 98 | As is | 100 g |
| P-856079557 | 95 | As is | by resynthesis (? - ? days) |
| P-31197300 | 90 | As is | 500 mg |
| P-895553532 | 95 | As is | by synthesis |
| P-885541970 | 95 | As is | by synthesis |
| P-906903757 | 98 | As is | in stock |
| P-906773834 | 98 | As is | by synthesis |
| P-906859801 | 97 | As is | by synthesis |
| P-893939411 | 95 | As is | in stock |
| P-893698025 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 337.367 |
| logP | 2.8788 |
| H-bond acceptors | 7 |
| H-bond donors | 2 |
| Rotatable bonds | 11 |
| PSA | 101.93 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 87.0485 |
| Atoms | 47 |
| Rings | 1 |
| Heavy atoms | 24 |
| Hydrogen atoms | 23 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
