MCULE-6257724782
- 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 | 43 USD | 95 | 12 working days | Get Quote |
| 5 mg | 91 USD | 98 | 16 working days | Get Quote |
| 10 mg | 117 USD | 98 | 11 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-6257724782.sdf |
| SMILES | MCULE-6257724782.smiles |
| Standard InChI | MCULE-6257724782.inchi |
| InChIKey | MCULE-6257724782.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867645476 | N/A | As is | in stock |
| P-875812002 | N/A | As is | in stock |
| P-590357030 | 98 | As is | by resynthesis (? - ? days) |
| P-893538103 | 90 | As is | 142 mg |
| P-1270278303 | 98 | As is | in stock |
| P-1264203391 | N/A | As is | by synthesis |
| P-489239938 | 97 | As is | in stock |
| P-1273462852 | 95 | As is | by resynthesis (? - ? days) |
| P-904970036 | 95 | As is | by synthesis |
| P-860054615 | 98 | As is | by synthesis |
| P-1264193788 | 98 | As is | by synthesis |
| P-881631453 | 98 | As is | in stock |
| P-861382322 | 95 | As is | by synthesis |
| P-579477187 | 95 | As is | in stock |
| P-855920363 | 97 | As is | 100 mg |
| P-852468644 | 95 | As is | by synthesis |
| P-854690532 | 95 | As is | in stock |
| P-619674506 | 98 | As is | in stock |
| P-889874845 | 95 | As is | by synthesis |
| P-869178605 | 95 | As is | in stock |
| P-892299599 | 95 | As is | unavailable |
| P-892274954 | 95 | As is | 214 mg |
| P-892351305 | 95 | As is | 214 mg |
| P-855315336 | 90 | As is | in stock |
| P-1271710920 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 358.341 |
| logP | 2.5104 |
| H-bond acceptors | 7 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 91.29 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 92.706 |
| Atoms | 44 |
| Rings | 3 |
| Heavy atoms | 26 |
| Hydrogen atoms | 18 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| 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 |

