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MCULE-4567990758
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 | 38 USD | 98 | 16 working days | Get Quote |
| 5 mg | 54 USD | 98 | 16 working days | Get Quote |
| 10 mg | 101 USD | 98 | 16 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4567990758.sdf |
| SMILES | MCULE-4567990758.smiles |
| Standard InChI | MCULE-4567990758.inchi |
| InChIKey | MCULE-4567990758.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903055948 | 97 | As is | 100 mg |
| P-1264058014 | 98 | As is | in stock |
| P-893618662 | 90 | As is | 2.578 g |
| P-617067213 | 95 | As is | in stock |
| P-489238293 | 97 | As is | in stock |
| P-888162170 | 95 | As is | by synthesis |
| P-900267103 | 95 | As is | in stock |
| P-1273139209 | 97 | As is | 100 mg |
| P-852468098 | 95 | As is | by synthesis |
| P-872798824 | 95 | As is | in stock |
| P-1272494984 | 95 | As is | in stock |
| P-584613828 | 95 | As is | in stock |
| P-619674047 | 98 | As is | in stock |
| P-901513590 | 95 | As an isomer | by synthesis |
| P-870646836 | 95 | As an isomer | in stock |
| P-454424972 | 95 | As an isomer | 100 mg |
| P-895740227 | 95 | As an isomer | by synthesis |
| P-885548580 | 95 | As an isomer | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 650.973 |
| logP | 4.653 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 5 |
| PSA | 92.78 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 112.1912 |
| Atoms | 35 |
| Rings | 2 |
| Heavy atoms | 23 |
| Hydrogen atoms | 12 |
| Heteroatoms | 8 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
