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UNKNOWN STEREO
MCULE-1515405641
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 | 181 USD | 95 | 7 working days | Get Quote |
| 5 mg | 415 USD | 95 | 15 working days | Get Quote |
| 10 mg | 655 USD | 95 | 15 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1515405641.sdf |
| SMILES | MCULE-1515405641.smiles |
| Standard InChI | MCULE-1515405641.inchi |
| InChIKey | MCULE-1515405641.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-901274862 | N/A | As is | in stock |
| P-851432647 | N/A | As is | by synthesis |
| P-1274623176 | N/A | As is | 25 mg |
| P-893243383 | 95 | As is | in stock |
| P-904246819 | 95 | As is | unavailable |
| P-892227105 | 95 | As is | 51 mg |
| P-892320738 | 95 | As is | 51 mg |
| P-611556024 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 400.284 |
| logP | -0.7901 |
| H-bond acceptors | 13 |
| H-bond donors | 5 |
| Rotatable bonds | 4 |
| PSA | 200.81 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 90.3421 |
| Atoms | 44 |
| Rings | 4 |
| Heavy atoms | 27 |
| Hydrogen atoms | 17 |
| Heteroatoms | 14 |
| N/O atoms | 13 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 4 |
| R/S chiral centers | 4 |
| 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 |
