MCULE-2297918209
- 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 | 26 USD | 98 | 14 working days | Get Quote |
| 5 mg | 28 USD | 98 | 16 working days | Get Quote |
| 10 mg | 47 USD | 98 | 16 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-2297918209.sdf |
| SMILES | MCULE-2297918209.smiles |
| Standard InChI | MCULE-2297918209.inchi |
| InChIKey | MCULE-2297918209.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867553414 | N/A | As is | in stock |
| P-875711999 | N/A | As is | in stock |
| P-872724344 | 98 | As is | in stock |
| P-903038592 | 98 | As is | 500 mg |
| P-1264047471 | 100 | As is | in stock |
| P-489237904 | 97 | As is | in stock |
| P-596982169 | 98 | As is | 250 mg |
| P-864150093 | 95 | As is | in stock |
| P-860055840 | 98 | As is | by synthesis |
| P-868543709 | 99 | As is | in stock |
| P-893218734 | 95 | As is | in stock |
| P-851249192 | 95 | As is | by synthesis |
| P-860798589 | 98 | As is | in stock |
| P-580450594 | 99 | As is | in stock |
| P-608494256 | 95 | As is | in stock |
| P-580403548 | 95 | As is | by resynthesis (? - ? days) |
| P-870660078 | N/A | As is | in stock |
| P-675216072 | 95 | As is | in stock |
| P-852522994 | 95 | As is | by synthesis |
| P-854713903 | 95 | As is | in stock |
| P-1263153989 | 95 | As is | by synthesis |
| P-474020797 | 95 | As is | in stock |
| P-608273218 | 98 | As is | in stock |
| P-885539977 | 95 | As is | by synthesis |
| P-579711276 | 98 | As is | in stock |
| P-892290266 | 95 | As is | unavailable |
| P-869124035 | 95 | As is | 136 mg |
| P-888637957 | 95 | As is | 79 mg |
| P-906762076 | 98 | As is | by synthesis |
| P-611493583 | 90 | As is | in stock |
| P-611429475 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 555.235 |
| logP | 6.2186 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 50.16 |
| RO5 violations | 2 |
| RO3 violations | 4 |
| Refractivity | 133.6242 |
| Atoms | 51 |
| Rings | 4 |
| Heavy atoms | 30 |
| Hydrogen atoms | 21 |
| Heteroatoms | 8 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |

