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MCULE-3880291457
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 | 70 USD | 90 | 22 working days | Get Quote |
| 5 mg | 97 USD | 90 | 17 working days | Get Quote |
| 10 mg | 134 USD | 90 | 35 working days | Get Quote |
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1
MCULE-8901563206
- Component type: Main
-
1
MCULE-6647815245
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3880291457.sdf |
| SMILES | MCULE-3880291457.smiles |
| Standard InChI | MCULE-3880291457.inchi |
| InChIKey | MCULE-3880291457.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-892447537 | Asinex | General screening catalog | 90 | As is | unavailable |
| P-674278705 | ChemDiv | Discovery Chemistry Library | 90 | As is | 19 mg |
| P-34561749 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-596491331 | Asinex | General bb catalog | 90 | Main component | unavailable |
| P-5101967 | ChemBridge | EXPRESS-Pick Collection | 90 | Main component | 9 mg |
| P-888354045 | TimTec | ActiMol 4 Week - On demand | 94 | Main component | by resynthesis (? - ? days) |
| P-3241840 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | Main component | unavailable |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 309.361 |
| logP | 0.639 |
| H-bond acceptors | 7 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 93.97 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 89.6316 |
| Atoms | 45 |
| Rings | 2 |
| Heavy atoms | 22 |
| Hydrogen atoms | 23 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| 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 |
