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UNKNOWN STEREO
MCULE-3460991063-1
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 | 28 USD | 92 | 18 working days | Get Quote |
| 5 mg | 43 USD | 92 | 18 working days | Get Quote |
| 10 mg | 54 USD | 92 | 18 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-7557281257-0
- Component type: Unknown
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MCULE-9989636938-0
- Component type: Main
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MCULE-5839633766-0
- Component type: Main
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MCULE-9859991443-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3460991063-1.sdf |
| SMILES | MCULE-3460991063-1.smiles |
| Standard InChI | MCULE-3460991063-1.inchi |
| InChIKey | MCULE-3460991063-1.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-518134753 | 95 | As a main component | 200 mg |
| P-854615549 | 95 | As a main component | 300 mg |
| P-618042029 | 95 | As a main component | 170 mg |
| P-674704099 | 92 | As a main component | 300 mg |
| P-674703496 | 92 | As a main component | 170 mg |
| P-575378298 | 92 | As a main component | 200 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 537.623 |
| logP | 3.8293 |
| H-bond acceptors | 9 |
| H-bond donors | 2 |
| Rotatable bonds | 10 |
| PSA | 126.02 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 148.0819 |
| Atoms | 76 |
| Rings | 4 |
| Heavy atoms | 39 |
| Hydrogen atoms | 37 |
| Heteroatoms | 9 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
