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MCULE-4290013822-0
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 | 24 USD | 95 | 19 working days | Get Quote |
| 5 mg | 24 USD | 95 | 19 working days | Get Quote |
| 10 mg | 24 USD | 95 | 19 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4290013822-0.sdf |
| SMILES | MCULE-4290013822-0.smiles |
| Standard InChI | MCULE-4290013822-0.inchi |
| InChIKey | MCULE-4290013822-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875769448 | 95 | As is | in stock |
| P-1275188611 | 97 | As is | in stock |
| P-1275184300 | 95 | As is | in stock |
| P-1273265954 | 95 | As is | by resynthesis (? - ? days) |
| P-872748853 | 97 | As is | in stock |
| P-454415372 | 90 | As is | 1.866 g |
| P-18817106 | 90 | As is | 1.866 g |
| P-904073043 | 95 | As is | in stock |
| P-888173761 | 98 | As is | by synthesis |
| P-869124801 | 95 | As is | 644 mg |
| P-892290502 | 95 | As is | 644 mg |
| P-888638505 | 95 | As is | 644 mg |
| P-855015346 | 90 | As is | in stock |
| P-886916801 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 296.363 |
| logP | 3.6632 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 49.41 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 86.5087 |
| Atoms | 42 |
| Rings | 2 |
| Heavy atoms | 22 |
| Hydrogen atoms | 20 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
