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MCULE-5798545860-1
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 | 48 USD | 98 | 20 working days | Get Quote |
| 5 mg | 48 USD | 98 | 20 working days | Get Quote |
| 10 mg | 48 USD | 98 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-5798545860-1.sdf |
| SMILES | MCULE-5798545860-1.smiles |
| Standard InChI | MCULE-5798545860-1.inchi |
| InChIKey | MCULE-5798545860-1.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1266125159 | 98 | As is | in stock |
| P-597013983 | 95 | As is | unavailable |
| P-902994541 | 95 | As is | by resynthesis (? - ? days) |
| P-1270405073 | 95 | As is | in stock |
| P-856052936 | 95 | As is | by synthesis |
| P-901181258 | N/A | As is | in stock |
| P-900248482 | 98 | As is | 2 g |
| P-1273384426 | 95 | As is | by resynthesis (? - ? days) |
| P-901336246 | 95 | As is | in stock |
| P-901924462 | 95 | As is | 3.67 g |
| P-872749999 | 98 | As is | in stock |
| P-675513463 | 95 | As is | in stock |
| P-579689558 | 95 | As is | by resynthesis (? - ? days) |
| P-613319894 | 95 | As is | by synthesis |
| P-895605964 | 95 | As is | by synthesis |
| P-906878931 | 95 | As is | by synthesis |
| P-855232478 | 90 | As is | in stock |
| P-588804450 | N/A | As is | by synthesis |
| P-1271684928 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 281.105 |
| logP | 2.6258 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 54.98 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 63.0032 |
| Atoms | 25 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 9 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
