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UNKNOWN STEREO
MCULE-9445167639
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 | 9 working days | Get Quote |
| 5 mg | 8 USD | N/A | 9 working days | Get Quote |
| 10 mg | 9 USD | 98 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9445167639.sdf |
| SMILES | MCULE-9445167639.smiles |
| Standard InChI | MCULE-9445167639.inchi |
| InChIKey | MCULE-9445167639.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867566522 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875725972 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869194720 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-869358119 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-505399672 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-606905550 | AmBeed | In stock | N/A | As is | in stock |
| P-596947243 | Angene | Building Blocks in stock | 98 | As is | 200 g |
| P-864126033 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-868544339 | Axon Medchem | Axon predominantly SC catalog | 99 | As is | in stock |
| P-893219144 | Biosynth | In Stock | 95 | As is | in stock |
| P-893221840 | Biosynth | In Stock | 95 | As is | in stock |
| P-505544677 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-856010028 | Key Organics | Biochemicals | 95 | As is | 100 mg |
| P-869122886 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892290058 | TargetMol | In Stock BB | 95 | As is | 500 mg |
| P-888637146 | TargetMol | Screening Compounds - stock amount | 95 | As is | 500 mg |
| P-893949074 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 440.496 |
| logP | 4.7364 |
| H-bond acceptors | 8 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 99.16 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 131.0134 |
| Atoms | 57 |
| Rings | 5 |
| Heavy atoms | 33 |
| Hydrogen atoms | 24 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
