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MCULE-4613049132
Compound
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- 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 | 109 USD | 90 | 20 working days | Get Quote |
| 5 mg | 109 USD | 90 | 20 working days | Get Quote |
| 10 mg | 109 USD | 90 | 20 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-4613049132.sdf |
| SMILES | MCULE-4613049132.smiles |
| Standard InChI | MCULE-4613049132.inchi |
| InChIKey | MCULE-4613049132.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-97740 | Chemical Block | Screening Library | 90 | As is | 223 mg |
| P-596283591 | Asinex | General screening catalog | 90 | As an isomer | 181 mg |
| P-856014535 | LaboTest | Screening Collection | 90 | As an isomer | 500 mg |
| P-33482616 | TimTec | ActiMol 3 Week | 90 | As an isomer | in stock |
| P-22535498 | TimTec | ActiMol 1 Week - Stock | 90 | As an isomer | 27 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 219.265 |
| logP | 1.5683 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 79.12 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 65.5927 |
| Atoms | 24 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 9 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 2 |
| Cis/trans stereo double bonds | 2 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
