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MCULE-1897312553-0
Structure
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- 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 | 13 USD | 98 | 11 working days | Get Quote |
| 5 mg | 13 USD | 98 | 11 working days | Get Quote |
| 10 mg | 13 USD | 98 | 11 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1897312553-0.sdf |
| SMILES | MCULE-1897312553-0.smiles |
| Standard InChI | MCULE-1897312553-0.inchi |
| InChIKey | MCULE-1897312553-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-580454756 | 95 | As is | unavailable |
| P-893604601 | 90 | As is | 1.44208 kg |
| P-489167320 | 97 | As is | in stock |
| P-900155001 | 95 | As is | in stock |
| P-580699048 | 98 | As is | 5.4 g |
| P-900267543 | N/A | As is | by resynthesis (? - ? days) |
| P-852003118 | 98 | As is | in stock |
| P-851247350 | 95 | As is | by synthesis |
| P-896544392 | 98 | As is | in stock |
| P-579478705 | 95 | As is | in stock |
| P-1264330873 | 97 | As is | 178.9 g |
| P-1264369753 | 97 | As is | 450 mg |
| P-1272597607 | 95 | As is | 50 g |
| P-852522442 | 95 | As is | by synthesis |
| P-854692731 | 95 | As is | in stock |
| P-1263159405 | 95 | As is | in stock |
| P-584619040 | 95 | As is | in stock |
| P-608276523 | 98 | As is | in stock |
| P-579710955 | N/A | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 410.500 |
| logP | 1.5199 |
| H-bond acceptors | 7 |
| H-bond donors | 3 |
| Rotatable bonds | 3 |
| PSA | 113.29 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 106.7014 |
| Atoms | 63 |
| Rings | 3 |
| Heavy atoms | 29 |
| Hydrogen atoms | 34 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 8 |
| R/S chiral centers | 8 |
| 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 |
