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MCULE-5131131173
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 | 28 USD | 95 | 14 working days | Get Quote |
| 5 mg | 67 USD | 92 | 15 working days | Get Quote |
| 10 mg | 86 USD | 90 | 24 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-5131131173.sdf |
| SMILES | MCULE-5131131173.smiles |
| Standard InChI | MCULE-5131131173.inchi |
| InChIKey | MCULE-5131131173.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1266341234 | 95 | As is | in stock |
| P-901320983 | 95 | As is | in stock |
| P-903461207 | 95 | As is | 1.25 g |
| P-1270388245 | 98 | As is | in stock |
| P-900254645 | 95 | As is | 4.5 g |
| P-889782684 | 95 | As is | in stock |
| P-5293716 | 90 | As is | 43 mg |
| P-889729603 | 95 | As is | by synthesis |
| P-34550616 | 90 | As is | by synthesis |
| P-13465030 | 92 | As is | 300 mg |
| P-899783822 | 95 | As is | 1 mg |
| P-1272507042 | 95 | As is | in stock |
| P-23877671 | 90 | As is | in stock |
| P-22832961 | 90 | As is | in stock |
| P-906858837 | 98 | As is | by synthesis |
| P-1218907 | 90 | As is | 118 mg |
| P-1279559921 | 98 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 444.449 |
| logP | 4.6362 |
| H-bond acceptors | 6 |
| H-bond donors | 0 |
| Rotatable bonds | 6 |
| PSA | 50.72 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 121.952 |
| Atoms | 55 |
| Rings | 4 |
| Heavy atoms | 32 |
| Hydrogen atoms | 23 |
| Heteroatoms | 9 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
