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UNKNOWN STEREO
MCULE-3370434329
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 | 101 USD | 95 | 22 working days | Get Quote |
| 5 mg | 242 USD | 99 | 8 working days | Get Quote |
| 10 mg | 485 USD | 95 | 22 working days | Get Quote |
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MCULE-5389590085
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3370434329.sdf |
| SMILES | MCULE-3370434329.smiles |
| Standard InChI | MCULE-3370434329.inchi |
| InChIKey | MCULE-3370434329.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-892861169 | 99 | As is | in stock |
| P-851456283 | N/A | As is | by synthesis |
| P-895097967 | N/A | As is | 10 mg |
| P-864263450 | 98 | As is | by synthesis |
| P-901426212 | 95 | As is | by synthesis |
| P-860798863 | 98 | As is | in stock |
| P-867620018 | 95 | As a main component | in stock |
| P-595215033 | 98 | As a main component | by resynthesis (? - ? days) |
| P-580195412 | 98 | As a main component | in stock |
| P-851508367 | N/A | As a main component | by synthesis |
| P-881102067 | 98 | As a main component | 8 mg |
| P-869420318 | 95 | As a main component | by synthesis |
| P-868544836 | 99 | As a main component | in stock |
| P-901555935 | 95 | As a main component | by synthesis |
| P-860798862 | 98 | As a main component | in stock |
| P-869110621 | 95 | As a main component | unavailable |
| P-888628831 | 95 | As a main component | unavailable |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 397.534 |
| logP | 1.9665 |
| H-bond acceptors | 7 |
| H-bond donors | 0 |
| Rotatable bonds | 6 |
| PSA | 86.38 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 116.428 |
| Atoms | 58 |
| Rings | 3 |
| Heavy atoms | 27 |
| Hydrogen atoms | 31 |
| Heteroatoms | 8 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 3 |
| 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 |
