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UNKNOWN STEREO
MCULE-7648905253
Compound
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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 | 27 USD | 95 | 7 working days | Get Quote |
| 5 mg | 27 USD | 95 | 7 working days | Get Quote |
| 10 mg | 37 USD | 95 | 7 working days | Get Quote |
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MCULE-8915550502
- Component type: Main
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MCULE-7313117745
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-7648905253.sdf |
| SMILES | MCULE-7648905253.smiles |
| Standard InChI | MCULE-7648905253.inchi |
| InChIKey | MCULE-7648905253.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867541107 | 98 | As is | in stock |
| P-875697574 | 98 | As is | in stock |
| P-619198974 | 98 | As is | 2.3 g |
| P-905462610 | 95 | As is | in stock |
| P-893223554 | 95 | As is | in stock |
| P-524440227 | 97 | As is | 909 mg |
| P-500409184 | 98 | As is | by synthesis |
| P-892296018 | 95 | As is | unavailable |
| P-594274519 | 95 | As is | 42 mg |
| P-888656932 | 95 | As is | 36 mg |
| P-893944068 | 98 | As is | in stock |
| P-867686263 | 98 | As a main component | in stock |
| P-875864079 | 98 | As a main component | in stock |
| P-865933252 | 98 | As a main component | 50 mg |
| P-488556304 | 92 | As a main component | in stock |
| P-904250779 | 95 | As a main component | unavailable |
| P-904220239 | 95 | As a main component | 102 mg |
| P-904237102 | 95 | As a main component | 102 mg |
| P-1271587346 | 98 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 2180.284 |
| logP | 0.5432 |
| H-bond acceptors | 57 |
| H-bond donors | 28 |
| Rotatable bonds | 86 |
| PSA | 901.57 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 550.2216 |
| Atoms | 293 |
| Rings | 6 |
| Heavy atoms | 155 |
| Hydrogen atoms | 138 |
| Heteroatoms | 57 |
| N/O atoms | 57 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 16 |
| R/S chiral centers | 16 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 1 |
