MCULE-2962455919
- 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 | 14 USD | N/A | 9 working days | Get Quote |
| 5 mg | 42 USD | 98 | 16 working days | Get Quote |
| 10 mg | 63 USD | 98 | 16 working days | Get Quote |
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MCULE-1130735547
- Component type: Main
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MCULE-6312391490
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2962455919.sdf |
| SMILES | MCULE-2962455919.smiles |
| Standard InChI | MCULE-2962455919.inchi |
| InChIKey | MCULE-2962455919.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867565508 | 95 | As is | in stock |
| P-875724885 | 95 | As is | in stock |
| P-595220876 | 95 | As is | by resynthesis (? - ? days) |
| P-1264048912 | 99 | As is | in stock |
| P-893584767 | 90 | As is | 35.532 g |
| P-851587531 | N/A | As is | by synthesis |
| P-489200101 | 97 | As is | in stock |
| P-596929059 | 95 | As is | 465 mg |
| P-1273452646 | 95 | As is | by resynthesis (? - ? days) |
| P-864149997 | 95 | As is | in stock |
| P-590844658 | 95 | As is | by synthesis |
| P-851297195 | 95 | As is | by synthesis |
| P-860799616 | 98 | As is | in stock |
| P-861384068 | 95 | As is | by synthesis |
| P-579479381 | 95 | As is | in stock |
| P-901407684 | 95 | As is | 465 mg |
| P-870652728 | 97 | As is | in stock |
| P-675213832 | 95 | As is | in stock |
| P-596562121 | 95 | As is | 100 mg |
| P-854711557 | 95 | As is | in stock |
| P-896628432 | 95 | As is | by synthesis |
| P-608276648 | 98 | As is | in stock |
| P-892289399 | 95 | As is | unavailable |
| P-869120281 | 95 | As is | 50 mg |
| P-888635093 | 95 | As is | 50 mg |
| P-575318434 | 98 | As is | in stock |
| P-875811628 | 97 | As a main component | in stock |
| P-869355516 | 95 | As a main component | by resynthesis (? - ? days) |
| P-903173070 | 97 | As a main component | 250 mg |
| P-1270296028 | 97 | As a main component | in stock |
| P-851950115 | N/A | As a main component | in stock |
| P-619162102 | 97 | As a main component | 100 mg |
| P-1273376141 | 95 | As a main component | by resynthesis (? - ? days) |
| P-864133294 | 95 | As a main component | in stock |
| P-611004794 | 97 | As a main component | 5.05 g |
| P-871219853 | N/A | As a main component | by resynthesis (? - ? days) |
| P-861514199 | 95 | As a main component | by synthesis |
| P-1273133675 | 97 | As a main component | 250 mg |
| P-855920365 | 97 | As a main component | 1 mg |
| P-854694710 | 95 | As a main component | by synthesis |
| P-1263957783 | 90 | As a main component | in stock |
| P-885537669 | 95 | As a main component | by synthesis |
| P-906802198 | 97 | As a main component | by synthesis |
| P-611445033 | 90 | As a main component | in stock |
| P-1271722144 | 97 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 371.340 |
| logP | 2.4767 |
| H-bond acceptors | 8 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 126.81 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 98.8176 |
| Atoms | 44 |
| Rings | 3 |
| Heavy atoms | 27 |
| Hydrogen atoms | 17 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| 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 |

