MCULE-7941043399-0
- 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 | 25 USD | 98 | 22 working days | Get Quote |
| 5 mg | 25 USD | 98 | 22 working days | Get Quote |
| 10 mg | 26 USD | 98 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-7941043399-0.sdf |
| SMILES | MCULE-7941043399-0.smiles |
| Standard InChI | MCULE-7941043399-0.inchi |
| InChIKey | MCULE-7941043399-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867539932 | N/A | As is | in stock |
| P-875696332 | 98 | As is | in stock |
| P-869211176 | 98 | As is | by resynthesis (? - ? days) |
| P-872726275 | 98 | As is | in stock |
| P-903018146 | 98 | As is | 75 g |
| P-1264051698 | 100 | As is | in stock |
| P-893608753 | 90 | As is | 27 g |
| P-851560776 | N/A | As is | by synthesis |
| P-489123692 | 97 | As is | in stock |
| P-596986310 | 98 | As is | 25 g |
| P-1273265276 | 95 | As is | by resynthesis (? - ? days) |
| P-895925442 | 95 | As is | by resynthesis (? - ? days) |
| P-864197622 | 95 | As is | in stock |
| P-590808910 | 95 | As is | by synthesis |
| P-893231633 | 95 | As is | in stock |
| P-454733380 | 90 | As is | in stock |
| P-448676418 | 90 | As is | 206 mg |
| P-436473391 | 95 | As is | in stock |
| P-425203301 | 90 | As is | in stock |
| P-34858923 | 90 | As is | in stock |
| P-871217986 | 95 | As is | by synthesis |
| P-889032678 | 95 | As is | in stock |
| P-580432097 | 95 | As is | by resynthesis (? - ? days) |
| P-870659660 | N/A | As is | in stock |
| P-1273109150 | 97 | As is | 100 mg |
| P-31129388 | 90 | As is | 10 g |
| P-856042831 | 90 | As is | 10 g |
| P-852533312 | N/A | As is | by synthesis |
| P-895182917 | 95 | As is | in stock |
| P-872666399 | 95 | As is | in stock |
| P-888172069 | 98 | As is | by synthesis |
| P-888892052 | N/A | As is | in stock |
| P-892298893 | 95 | As is | unavailable |
| P-869163131 | 95 | As is | 201 mg |
| P-888658531 | 95 | As is | 201 mg |
| P-502364637 | 90 | As is | in stock |
| P-888438668 | 94 | As is | by resynthesis (? - ? days) |
| P-906759116 | 99 | As is | by synthesis |
| P-855065632 | 90 | As is | in stock |
| P-615414980 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 208.296 |
| logP | 3.7414 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 7 |
| PSA | 29.46 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 63.799 |
| Atoms | 35 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 20 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |

