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UNKNOWN STEREO
MCULE-2215911951
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.
|
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 | 13 USD | 97 | 9 working days | Get Quote |
| 5 mg | 13 USD | 97 | 9 working days | Get Quote |
| 10 mg | 13 USD | 97 | 9 working days | Get Quote |
New customers are eligible for 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-2215911951.sdf |
| SMILES | MCULE-2215911951.smiles |
| Standard InChI | MCULE-2215911951.inchi |
| InChIKey | MCULE-2215911951.txt |
| mcule product ID | Supplier | Catalog | Purity (%) | Product matching | Availability | Updated |
|---|---|---|---|---|---|---|
| P-505353595 | AK Scientific | Building Blocks | 99 | As is | in stock | July 13, 2018 |
| P-505351091 | AK Scientific | Building Blocks | 98 | As is | in stock | July 13, 2018 |
| P-580247989 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis | April 8, 2017 |
| P-551978498 | Ark Pharm Inc. | In-stock Building Blocks | 97 | As is | in stock | May 1, 2018 |
| P-580170278 | Bide Pharmatech | Bide Pharmatech In Stock | 97 | As is | in stock | July 7, 2017 |
| P-580288155 | Debye Scientific | General Catalog | N/A | As is | by resynthesis (? - ? days) | May 31, 2018 |
| P-457488122 | Enamine | HTS Collection | 90 | As is | 100 mg | 1 hour ago |
| P-579571533 | HTS Biochemie Innovationen GmbH | Screening Compounds | 95 | As is | 10.03 g | January 2, 2018 |
| P-579484483 | HTS Biochemie Innovationen GmbH | Building Blocks | 95 | As is | 10.03 g | April 1 |
| P-579529750 | HTS Biochemie Innovationen GmbH | Building Blocks - small amounts | 95 | As is | 10.03 g | April 1 |
| P-502350203 | TimTec | Building Block Collection | 90 | As is | in stock | February 1, 2015 |
| P-575296479 | eNovation Chemicals LLC | Building Blocks | 95 | As is | in stock | July 10, 2018 |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 131.173 |
| logP | 1.1447 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 63.32 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 35.4352 |
| Atoms | 22 |
| Rings | 0 |
| Heavy atoms | 9 |
| Hydrogen atoms | 13 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
