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UNKNOWN STEREO
MCULE-1716939647
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 | 7 USD | N/A | 14 working days | Get Quote |
| 5 mg | 7 USD | N/A | 14 working days | Get Quote |
| 10 mg | 7 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-1716939647.sdf |
| SMILES | MCULE-1716939647.smiles |
| Standard InChI | MCULE-1716939647.inchi |
| InChIKey | MCULE-1716939647.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867585719 | A2B Chem | Predominantly Building Block in stock | 99 | As is | in stock |
| P-875744143 | AA Blocks | AA Blocks | N/A | As is | in stock |
| P-606885379 | AmBeed | In stock | N/A | As is | in stock |
| P-596954167 | Angene | Building Blocks in stock | 99 | As is | 2.34897 kg |
| P-864140211 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-675211451 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-492243228 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-578136820 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-583850788 | InterBioScreen | Bioactive compounds | 92 | As is | in stock |
| P-500374489 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-888633349 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869118272 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-502339998 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611356102 | Toronto Research | In stock | 90 | As is | in stock |
| P-2376827 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.944 g |
| P-464689893 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.944 g |
| P-575296369 | eNovation Chemicals LLC | Building Blocks in stock | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 217.288 |
| logP | 0.5658 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 96.41 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 59.9748 |
| Atoms | 29 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 15 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
