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MCULE-1372357420
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 | 55 USD | 85 | 21 working days | Get Quote |
| 5 mg | 64 USD | 85 | 21 working days | Get Quote |
| 10 mg | 133 USD | 90 | 35 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1372357420.sdf |
| SMILES | MCULE-1372357420.smiles |
| Standard InChI | MCULE-1372357420.inchi |
| InChIKey | MCULE-1372357420.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-504721067 | ChemBridge | RUSH - EXPRESS PICK LIBRARY | 85 | As is | 5 mg |
| P-619855092 | ChemDiv | Discovery Chemistry Library | 90 | As is | 2 mg |
| P-34578259 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-22538162 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 24 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 216.235 |
| logP | 1.8521 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 48.03 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 62.361 |
| Atoms | 28 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 12 |
| Heteroatoms | 4 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
