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MCULE-4253680610
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 | 64 USD | 85 | 21 working days | Get Quote |
| 5 mg | 94 USD | 85 | 21 working days | Get Quote |
| 10 mg | 130 USD | 90 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4253680610.sdf |
| SMILES | MCULE-4253680610.smiles |
| Standard InChI | MCULE-4253680610.inchi |
| InChIKey | MCULE-4253680610.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-596496285 | Asinex | General bb catalog | 90 | As is | 49 mg |
| P-596445093 | Asinex | General screening catalog | 90 | As is | 49 mg |
| P-504655065 | ChemBridge | RUSH - EXPRESS PICK LIBRARY | 85 | As is | 5 mg |
| P-678503522 | ChemDiv | Discovery Chemistry Library | 90 | As is | 1 mg |
| P-203460 | Chemical Block | Screening Library | 90 | As is | unavailable |
| P-34498526 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-656157372 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
| P-18929167 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-22633184 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 2 mg |
| P-3244848 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 215 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 228.289 |
| logP | 2.3188 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 36.1 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 72.5147 |
| Atoms | 33 |
| Rings | 3 |
| Heavy atoms | 17 |
| Hydrogen atoms | 16 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
