Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
UNKNOWN STEREO
MCULE-8246024259
Compound
Show structure
In order to add this molecule to a collection you have to create an account.
Sign up for free
- 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 | 102 USD | 97 | 12 working days | Get Quote |
| 5 mg | 102 USD | 97 | 12 working days | Get Quote |
| 10 mg | 102 USD | 97 | 12 working days | Get Quote |
- 1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
- Toxicity checker Searching for substructures commonly found in toxic and promiscuous ligands.
- Property calculator Create a physicochemical property profile for the compound in a second.
- Similarity search Find analogs by similarity search.
- Substructure search Find analogs by substructure search.
-
MCULE-4325652125
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-8246024259.sdf |
| SMILES | MCULE-8246024259.smiles |
| Standard InChI | MCULE-8246024259.inchi |
| InChIKey | MCULE-8246024259.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1265830793 | 97 | As is | in stock |
| P-892792480 | 98 | As is | by resynthesis (? - ? days) |
| P-1270360362 | 97 | As is | in stock |
| P-606886157 | N/A | As is | in stock |
| P-1271953312 | 97 | As is | 2 g |
| P-864248444 | 95 | As is | by synthesis |
| P-864125975 | 96 | As is | in stock |
| P-851205293 | 96 | As is | in stock |
| P-500177229 | 96 | As is | in stock |
| P-1271688816 | 97 | As is | in stock |
| P-1265079135 | 95 | As a main component | by synthesis |
| P-894633119 | 95 | As a main component | by resynthesis (? - ? days) |
| P-853434124 | 98 | As a main component | by resynthesis (? - ? days) |
| P-851642140 | N/A | As a main component | by synthesis |
| P-1272016367 | 95 | As a main component | 500 mg |
| P-905461842 | 95 | As a main component | in stock |
| P-500177230 | 96 | As a main component | in stock |
| P-611495391 | 90 | As a main component | in stock |
| P-615465433 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 212.289 |
| logP | 1.4819 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 41.57 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 66.0027 |
| Atoms | 35 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 20 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
