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MCULE-4162969355
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 | 215 USD | 98 | 15 working days | Get Quote |
| 5 mg | 579 USD | 95 | 34 working days | Get Quote |
| 10 mg | 1040 USD | 95 | 34 working days | Get Quote |
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1
MCULE-3844439492
- Component type: Main
-
2
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4162969355.sdf |
| SMILES | MCULE-4162969355.smiles |
| Standard InChI | MCULE-4162969355.inchi |
| InChIKey | MCULE-4162969355.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-901916969 | 98 | As is | 1 mg |
| P-1263260435 | 95 | As is | by synthesis |
| P-860055757 | 98 | Main component | by synthesis |
| P-1275105253 | N/A | Main component | by resynthesis (? - ? days) |
| P-608493976 | 95 | Main component | in stock |
| P-872665753 | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 718.375 |
| logP | -0.3027 |
| H-bond acceptors | 23 |
| H-bond donors | 5 |
| Rotatable bonds | 2 |
| PSA | 354.93 |
| RO5 violations | 2 |
| RO3 violations | 4 |
| Refractivity | 140.2241 |
| Atoms | 69 |
| Rings | 7 |
| Heavy atoms | 47 |
| Hydrogen atoms | 22 |
| Heteroatoms | 27 |
| N/O atoms | 23 |
| Inorganic atoms | 2 |
| Halogen atoms | 0 |
| Chiral centers | 8 |
| R/S chiral centers | 8 |
| 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 |
