MCULE-9019842665
- 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 | 31 USD | 95 | 7 working days | Get Quote |
| 5 mg | 48 USD | 98 | 16 working days | Get Quote |
| 10 mg | 63 USD | 98 | 16 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9019842665.sdf |
| SMILES | MCULE-9019842665.smiles |
| Standard InChI | MCULE-9019842665.inchi |
| InChIKey | MCULE-9019842665.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867615526 | N/A | As is | in stock |
| P-875776184 | N/A | As is | in stock |
| P-874650102 | 97 | As is | by resynthesis (? - ? days) |
| P-903119443 | 98 | As is | 200 mg |
| P-893587657 | 90 | As is | 325 mg |
| P-851764846 | N/A | As is | by synthesis |
| P-895097015 | 98 | As is | 200 mg |
| P-896026111 | 95 | As is | in stock |
| P-860055021 | 98 | As is | by synthesis |
| P-619597170 | 95 | As is | by synthesis |
| P-1275106701 | N/A | As is | by resynthesis (? - ? days) |
| P-893239733 | 95 | As is | in stock |
| P-5471411 | 90 | As is | 10 mg |
| P-10657026 | 90 | As is | 1 mg |
| P-578050709 | 98 | As is | in stock |
| P-1263263941 | 95 | As is | by synthesis |
| P-428571920 | 90 | As is | in stock |
| P-502678673 | 90 | As is | in stock |
| P-617988650 | 92 | As is | 272 mg |
| P-873242368 | 97 | As is | 5 mg |
| P-854693122 | 95 | As is | in stock |
| P-619673356 | 98 | As is | in stock |
| P-26371231 | 90 | As is | 10 mg |
| P-18856475 | 90 | As is | in stock |
| P-516409846 | 80 | As is | 53 mg |
| P-869177771 | 95 | As is | in stock |
| P-892296202 | 95 | As is | unavailable |
| P-594274769 | 95 | As is | 51 mg |
| P-892338589 | 95 | As is | 51 mg |
| P-907288374 | 94 | As is | by resynthesis (? - ? days) |
| P-424719833 | 90 | As is | 64 mg |
| P-868530862 | 99 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 230.258 |
| logP | 3.138 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 39.44 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 67.73 |
| Atoms | 31 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 14 |
| Heteroatoms | 3 |
| 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 |

