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MCULE-5094138649
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 | 36 USD | 92 | 15 working days | Get Quote |
| 5 mg | 58 USD | 90 | 22 working days | Get Quote |
| 10 mg | 74 USD | 90 | 22 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-5094138649.sdf |
| SMILES | MCULE-5094138649.smiles |
| Standard InChI | MCULE-5094138649.inchi |
| InChIKey | MCULE-5094138649.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-605517463 | ChemBridge | RUSH - EXPRESS PICK LIBRARY | 90 | As is | 5 mg |
| P-4916688 | ChemDiv | Discovery Chemistry Library | 90 | As is | 2 mg |
| P-97331 | Chemical Block | Screening Library | 90 | As is | 1 mg |
| P-12524819 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-23836453 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-875274438 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 5 mg |
| P-398433 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 127 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 348.368 |
| logP | 2.2388 |
| H-bond acceptors | 6 |
| H-bond donors | 0 |
| Rotatable bonds | 5 |
| PSA | 60.77 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 96.0485 |
| Atoms | 46 |
| Rings | 3 |
| Heavy atoms | 25 |
| Hydrogen atoms | 21 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
