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MCULE-1091569412
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 | 143 USD | 98 | 11 working days | Get Quote |
| 5 mg | 143 USD | 98 | 11 working days | Get Quote |
| 10 mg | 286 USD | 98 | 11 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-1091569412.sdf |
| SMILES | MCULE-1091569412.smiles |
| Standard InChI | MCULE-1091569412.inchi |
| InChIKey | MCULE-1091569412.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-25954166 | AnalytiCon Discovery | Natural screening compounds (85%+) | 85 | As is | 100 mg |
| P-860055260 | AvaChem Scientific | All products | 98 | As is | by synthesis |
| P-611064432 | BLD pharm | Non-stock building blocks | 99 | As is | by synthesis |
| P-452656477 | Chemfaces | Natural Compounds | 98 | As is | in stock |
| P-887203221 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-888174423 | Molnova | On demand | 98 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 376.399 |
| logP | 1.1349 |
| H-bond acceptors | 7 |
| H-bond donors | 5 |
| Rotatable bonds | 5 |
| PSA | 119.61 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 98.5284 |
| Atoms | 51 |
| Rings | 3 |
| Heavy atoms | 27 |
| Hydrogen atoms | 24 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 3 |
| 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 |
