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UNKNOWN STEREO
MCULE-3551661109-0
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 | 6 USD | 97 | 22 working days | Get Quote |
| 5 mg | 6 USD | 97 | 22 working days | Get Quote |
| 10 mg | 6 USD | 97 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-3551661109-0.sdf |
| SMILES | MCULE-3551661109-0.smiles |
| Standard InChI | MCULE-3551661109-0.inchi |
| InChIKey | MCULE-3551661109-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867661825 | 97 | As is | in stock |
| P-875830607 | N/A | As is | in stock |
| P-869182517 | 95 | As is | in stock |
| P-505351425 | 98 | As is | in stock |
| P-580269293 | 95 | As is | by synthesis |
| P-606943407 | N/A | As is | in stock |
| P-596972837 | 98 | As is | 1000 g |
| P-881654017 | 98 | As is | in stock |
| P-864158215 | 95 | As is | in stock |
| P-893242139 | 95 | As is | in stock |
| P-861274503 | 95 | As is | in stock |
| P-580418414 | 95 | As is | by resynthesis (? - ? days) |
| P-892228565 | 95 | As is | by synthesis |
| P-869175998 | 95 | As is | in stock |
| P-892290972 | 95 | As is | 3.153 g |
| P-892321933 | 95 | As is | 3.153 g |
| P-502327437 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 347.221 |
| logP | -1.2818 |
| H-bond acceptors | 12 |
| H-bond donors | 5 |
| Rotatable bonds | 4 |
| PSA | 195.88 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 73.5841 |
| Atoms | 37 |
| Rings | 3 |
| Heavy atoms | 23 |
| Hydrogen atoms | 14 |
| Heteroatoms | 13 |
| N/O atoms | 12 |
| 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 |
