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UNKNOWN STEREO
MCULE-9661651155
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 | 8 USD | N/A | 14 working days | Get Quote |
| 5 mg | 27 USD | N/A | 14 working days | Get Quote |
| 10 mg | 27 USD | N/A | 14 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-9661651155.sdf |
| SMILES | MCULE-9661651155.smiles |
| Standard InChI | MCULE-9661651155.inchi |
| InChIKey | MCULE-9661651155.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-606950836 | AmBeed | In stock | N/A | As is | in stock |
| P-864100368 | AstaTech | In Stock BBs | 98 | As is | in stock |
| P-488556170 | InterBioScreen | Bioactive compounds | 92 | As is | in stock |
| P-445353669 | Pharmeks LLC | Natural & unique compounds | 92 | As is | 300 mg |
| P-869176267 | TargetMol | Natural Products | 95 | As is | 5.018 g |
| P-854963340 | Toronto Research | In stock | 90 | As is | in stock |
| P-594196378 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 57 mg |
| P-615456578 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 416.377 |
| logP | 0.3443 |
| H-bond acceptors | 9 |
| H-bond donors | 5 |
| Rotatable bonds | 4 |
| PSA | 149.82 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 104.0882 |
| Atoms | 50 |
| Rings | 4 |
| Heavy atoms | 30 |
| Hydrogen atoms | 20 |
| Heteroatoms | 9 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 5 |
| R/S chiral centers | 5 |
| 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 |
