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UNKNOWN STEREO
MCULE-4048536115
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 | 16 USD | 98 | 20 working days | Get Quote |
| 5 mg | 16 USD | 98 | 20 working days | Get Quote |
| 10 mg | 16 USD | 98 | 20 working days | Get Quote |
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1
MCULE-5533307091
- Component type: Main
-
1
MCULE-6124492894
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4048536115.sdf |
| SMILES | MCULE-4048536115.smiles |
| Standard InChI | MCULE-4048536115.inchi |
| InChIKey | MCULE-4048536115.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867537147 | 98 | As is | in stock |
| P-875692843 | 98 | As is | in stock |
| P-596936688 | 98 | As is | 890 mg |
| P-901428513 | 95 | As is | by synthesis |
| P-893236741 | 95 | As is | in stock |
| P-860799584 | 98 | As is | in stock |
| P-580452316 | 99 | As is | in stock |
| P-505516980 | 95 | As is | in stock |
| P-869107624 | 95 | As is | 938 mg |
| P-892286235 | 95 | As is | 684 mg |
| P-888626658 | 95 | As is | 684 mg |
| P-611360112 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 609.677 |
| logP | 5.2623 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 59.0 |
| RO5 violations | 2 |
| RO3 violations | 4 |
| Refractivity | 170.5098 |
| Atoms | 92 |
| Rings | 6 |
| Heavy atoms | 39 |
| Hydrogen atoms | 53 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 10 |
| R/S chiral centers | 10 |
| 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 |
