MCULE-2395456277
- 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 | 20 USD | 98 | 16 working days | Get Quote |
| 5 mg | 20 USD | 98 | 16 working days | Get Quote |
| 10 mg | 30 USD | 98 | 16 working days | Get Quote |
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MCULE-5738144634
- Component type: Main
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MCULE-3802202307
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2395456277.sdf |
| SMILES | MCULE-2395456277.smiles |
| Standard InChI | MCULE-2395456277.inchi |
| InChIKey | MCULE-2395456277.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867689336 | 95 | As is | in stock |
| P-875868014 | 97 | As is | in stock |
| P-874612605 | 97 | As is | by resynthesis (? - ? days) |
| P-903338906 | 97 | As is | 15 g |
| P-1264053439 | 95 | As is | in stock |
| P-1270354805 | 98 | As is | in stock |
| P-875894829 | 95 | As is | in stock |
| P-851945212 | N/A | As is | in stock |
| P-873301532 | 97 | As is | 8.05 g |
| P-1273265827 | 95 | As is | by resynthesis (? - ? days) |
| P-872696976 | 98 | As is | in stock |
| P-907573843 | 95 | As is | by synthesis |
| P-868545635 | 99 | As is | in stock |
| P-613257818 | 98 | As is | 6.25 g |
| P-893246067 | 95 | As is | in stock |
| P-868361675 | 95 | As is | by synthesis |
| P-861286314 | 98 | As is | in stock |
| P-861379338 | 95 | As is | by synthesis |
| P-868658382 | 95 | As is | in stock |
| P-854621282 | 98 | As is | in stock |
| P-1273143004 | 98 | As is | 8.05 g |
| P-873251361 | 97 | As is | 10 mg |
| P-854715381 | 95 | As is | in stock |
| P-1263156777 | 95 | As is | by synthesis |
| P-871071965 | 95 | As is | in stock |
| P-619674800 | 98 | As is | in stock |
| P-608372335 | 98 | As is | in stock |
| P-892299521 | 95 | As is | unavailable |
| P-869163411 | 95 | As is | 113 mg |
| P-888658771 | 95 | As is | 113 mg |
| P-906799257 | 99 | As is | by synthesis |
| P-1271674191 | 98 | As is | in stock |
| P-872840249 | 99 | As a main component | in stock |
| P-875874270 | 99 | As a main component | in stock |
| P-874604403 | N/A | As a main component | by resynthesis (? - ? days) |
| P-1264055700 | 99 | As a main component | in stock |
| P-1270367495 | 99 | As a main component | in stock |
| P-900259179 | N/A | As a main component | in stock |
| P-895110917 | 99 | As a main component | 10 g |
| P-1273386557 | 95 | As a main component | by resynthesis (? - ? days) |
| P-864324344 | 98 | As a main component | by synthesis |
| P-907572216 | 99 | As a main component | by synthesis |
| P-901923231 | 99 | As a main component | 1.435 g |
| P-888163769 | 95 | As a main component | by synthesis |
| P-887185480 | 95 | As a main component | by synthesis |
| P-900266191 | 95 | As a main component | in stock |
| P-873252456 | 97 | As a main component | 10 mg |
| P-854717766 | 95 | As a main component | in stock |
| P-895196464 | 95 | As a main component | by synthesis |
| P-1263156778 | 95 | As a main component | by synthesis |
| P-871071966 | 95 | As a main component | in stock |
| P-1271667281 | 99 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 585.696 |
| logP | 5.221 |
| H-bond acceptors | 11 |
| H-bond donors | 2 |
| Rotatable bonds | 14 |
| PSA | 113.85 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 171.3249 |
| Atoms | 82 |
| Rings | 4 |
| Heavy atoms | 43 |
| Hydrogen atoms | 39 |
| Heteroatoms | 11 |
| N/O atoms | 11 |
| 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 |

