MCULE-3136673508
- 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 | 19 USD | 97 | 22 working days | Get Quote |
| 5 mg | 29 USD | 97 | 14 working days | Get Quote |
| 10 mg | 39 USD | 97 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-3136673508.sdf |
| SMILES | MCULE-3136673508.smiles |
| Standard InChI | MCULE-3136673508.inchi |
| InChIKey | MCULE-3136673508.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867685521 | 97 | As is | in stock |
| P-875863188 | 97 | As is | in stock |
| P-869244729 | 95 | As is | by resynthesis (? - ? days) |
| P-903319098 | 97 | As is | 300 mg |
| P-1272346997 | 99 | As is | in stock |
| P-893527427 | 90 | As is | 3.185 g |
| P-1270372015 | 97 | As is | in stock |
| P-606873372 | N/A | As is | in stock |
| P-865932851 | 97 | As is | 250 mg |
| P-1273451267 | 95 | As is | by resynthesis (? - ? days) |
| P-864193471 | 95 | As is | in stock |
| P-606955200 | 97 | As is | 257 mg |
| P-901565358 | 95 | As is | by synthesis |
| P-851250660 | 95 | As is | by synthesis |
| P-861381962 | 95 | As is | by synthesis |
| P-868658449 | 95 | As is | in stock |
| P-854621501 | 98 | As is | in stock |
| P-862148172 | 97 | As is | 200 mg |
| P-1273110007 | 97 | As is | 9 mg |
| P-1272598025 | 95 | As is | 100 mg |
| P-852523645 | 95 | As is | by synthesis |
| P-1275598526 | 95 | As is | by synthesis |
| P-854718240 | 95 | As is | in stock |
| P-584616433 | 95 | As is | in stock |
| P-888172290 | 98 | As is | by synthesis |
| P-889881178 | 95 | As is | by synthesis |
| P-873287107 | N/A | As is | in stock |
| P-892299241 | 95 | As is | unavailable |
| P-869163298 | 95 | As is | 151 mg |
| P-888658671 | 95 | As is | 151 mg |
| P-855051342 | 90 | As is | in stock |
| P-1271706186 | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 240.282 |
| logP | 2.7185 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 71.09 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 69.121 |
| Atoms | 25 |
| Rings | 3 |
| Heavy atoms | 17 |
| Hydrogen atoms | 8 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |

