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UNKNOWN STEREO
MCULE-9233091690
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 | 41 USD | N/A | 14 working days | Get Quote |
| 5 mg | 105 USD | N/A | 14 working days | Get Quote |
| 10 mg | 151 USD | 95 | 11 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9233091690.sdf |
| SMILES | MCULE-9233091690.smiles |
| Standard InChI | MCULE-9233091690.inchi |
| InChIKey | MCULE-9233091690.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867678206 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-869299780 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-606866630 | AmBeed | In stock | N/A | As is | in stock |
| P-868835230 | Angene | Building Blocks in stock | 98 | As is | 350 mg |
| P-881651944 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-889559995 | AstaTech | In Stock BBs | 98 | As is | in stock |
| P-868545804 | Axon Medchem | Axon predominantly SC catalog | 99 | As is | in stock |
| P-675215201 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-888656143 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-555325988 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-868497918 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 558.071 |
| logP | 5.1352 |
| H-bond acceptors | 9 |
| H-bond donors | 3 |
| Rotatable bonds | 10 |
| PSA | 106.25 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 163.2436 |
| Atoms | 72 |
| Rings | 5 |
| Heavy atoms | 40 |
| Hydrogen atoms | 32 |
| Heteroatoms | 10 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
