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UNKNOWN STEREO
MCULE-5037920313-0
Structure
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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 | 31 USD | 98 | 20 working days | Get Quote |
| 5 mg | 71 USD | 95 | 7 working days | Get Quote |
| 10 mg | 112 USD | 95 | 7 working days | Get Quote |
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1
MCULE-5428359908-0
- Component type: Main
-
1
MCULE-8295936189-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5037920313-0.sdf |
| SMILES | MCULE-5037920313-0.smiles |
| Standard InChI | MCULE-5037920313-0.inchi |
| InChIKey | MCULE-5037920313-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-889592201 | 95 | As is | in stock |
| P-500409737 | 98 | As is | by synthesis |
| P-892296019 | 95 | As is | unavailable |
| P-594274520 | 95 | As is | 38 mg |
| P-888656933 | 95 | As is | 88 mg |
| P-611509101 | 90 | As is | in stock |
| P-868502569 | 98 | As is | in stock |
| P-886659910 | 99 | Main component | in stock |
| P-890178147 | 99 | Main component | in stock |
| P-590380979 | 98 | Main component | by resynthesis (? - ? days) |
| P-881109497 | 98 | Main component | 25 mg |
| P-889848464 | 95 | Main component | by synthesis |
| P-505546512 | 95 | Main component | in stock |
| P-524440233 | 97 | Main component | 9 mg |
| P-864301297 | 95 | Main component as a main component | by synthesis |
| P-869161580 | 95 | Main component as a main component | 202 mg |
| P-888656934 | 95 | Main component as a main component | 202 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 1491.087 |
| logP | 6.0232 |
| H-bond acceptors | 33 |
| H-bond donors | 18 |
| Rotatable bonds | 50 |
| PSA | 532.97 |
| RO5 violations | 4 |
| RO3 violations | 6 |
| Refractivity | 393.7762 |
| Atoms | 202 |
| Rings | 6 |
| Heavy atoms | 106 |
| Hydrogen atoms | 96 |
| Heteroatoms | 34 |
| N/O atoms | 33 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
