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UNKNOWN STEREO
MCULE-3054080957-0
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 | 10 USD | 98 | 20 working days | Get Quote |
| 5 mg | 13 USD | 98 | 22 working days | Get Quote |
| 10 mg | 20 USD | 98 | 22 working days | Get Quote |
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MCULE-1959839889-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3054080957-0.sdf |
| SMILES | MCULE-3054080957-0.smiles |
| Standard InChI | MCULE-3054080957-0.inchi |
| InChIKey | MCULE-3054080957-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867636318 | 98 | As is | in stock |
| P-875801344 | 98 | As is | in stock |
| P-889055439 | 98 | As is | by resynthesis (? - ? days) |
| P-580195817 | 98 | As is | in stock |
| P-1270294741 | 98 | As is | in stock |
| P-606837443 | N/A | As is | in stock |
| P-597008738 | 98 | As is | 5 g |
| P-864127628 | 95 | As is | in stock |
| P-901413883 | 95 | As is | in stock |
| P-580452659 | 98 | As is | in stock |
| P-580439024 | 95 | As is | by resynthesis (? - ? days) |
| P-868078330 | 95 | As is | in stock |
| P-488555552 | 92 | As is | in stock |
| P-892287772 | 95 | As is | unavailable |
| P-892216219 | 95 | As is | 50 mg |
| P-892312342 | 95 | As is | 50 mg |
| P-611472250 | 90 | As is | in stock |
| P-578076963 | 90 | As is | 5 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 176.215 |
| logP | 1.3128 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 33.2 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 53.328 |
| Atoms | 25 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 12 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
