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UNKNOWN STEREO
MCULE-5603801612-0
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 | 44 USD | 90 | 21 working days | Get Quote |
| 5 mg | 71 USD | 90 | 21 working days | Get Quote |
| 10 mg | 85 USD | 90 | 21 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-5603801612-0.sdf |
| SMILES | MCULE-5603801612-0.smiles |
| Standard InChI | MCULE-5603801612-0.inchi |
| InChIKey | MCULE-5603801612-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886525531 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-889901401 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-869274444 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-899962707 | AmBeed | In stock | N/A | As is | in stock |
| P-596939494 | Angene | Building Blocks in stock | 95 | As is | 5 g |
| P-889773650 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-12389335 | Otava | In-House Stock Library | 90 | As is | 523 mg |
| P-492274033 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 523 mg |
| P-611534200 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 250.336 |
| logP | 3.1723 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 7 |
| PSA | 64.35 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 72.2781 |
| Atoms | 40 |
| Rings | 1 |
| Heavy atoms | 18 |
| Hydrogen atoms | 22 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
