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MCULE-1987318948
Compound
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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 | 67 USD | 95 | 12 working days | Get Quote |
| 5 mg | 212 USD | 95 | 12 working days | Get Quote |
| 10 mg | 325 USD | 95 | 15 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1987318948.sdf |
| SMILES | MCULE-1987318948.smiles |
| Standard InChI | MCULE-1987318948.inchi |
| InChIKey | MCULE-1987318948.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-892870413 | 97 | As is | in stock |
| P-613853484 | 95 | As is | by resynthesis (? - ? days) |
| P-580235252 | 95 | As is | by synthesis |
| P-851811942 | N/A | As is | by synthesis |
| P-875891216 | N/A | As is | 400 mg |
| P-1273289220 | 95 | As is | by resynthesis (? - ? days) |
| P-896025725 | 95 | As is | in stock |
| P-893236408 | 95 | As is | in stock |
| P-901451179 | 95 | As is | by synthesis |
| P-878210072 | 95 | As is | 5 mg |
| P-873242340 | 97 | As is | 5 mg |
| P-892306955 | 95 | As is | in stock |
| P-1274336073 | 95 | As is | unavailable |
| P-869169346 | 95 | As is | 198 mg |
| P-888662375 | 95 | As is | 196 mg |
| P-611484460 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 226.269 |
| logP | 3.5712 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 29.46 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 70.327 |
| Atoms | 31 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 14 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
