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MCULE-3539561862-0
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 | 36 USD | 92 | 15 working days | Get Quote |
| 5 mg | 67 USD | 92 | 15 working days | Get Quote |
| 10 mg | 88 USD | 90 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-3539561862-0.sdf |
| SMILES | MCULE-3539561862-0.smiles |
| Standard InChI | MCULE-3539561862-0.inchi |
| InChIKey | MCULE-3539561862-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886731972 | 95 | As is | in stock |
| P-890030649 | 90 | As is | by synthesis |
| P-874611512 | 97 | As is | by resynthesis (? - ? days) |
| P-904744264 | N/A | As is | by synthesis |
| P-905528586 | 95 | As is | by synthesis |
| P-901518683 | 95 | As is | by synthesis |
| P-892211741 | 90 | As is | 5 mg |
| P-12437389 | 92 | As is | 283 mg |
| P-854856625 | 95 | As is | by synthesis |
| P-424944402 | 90 | As is | in stock |
| P-1827053 | 90 | As is | 64 mg |
| P-893811594 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 310.396 |
| logP | 2.1433 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 125.73 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 80.8738 |
| Atoms | 34 |
| Rings | 3 |
| Heavy atoms | 20 |
| Hydrogen atoms | 14 |
| Heteroatoms | 7 |
| N/O atoms | 5 |
| 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 |
