Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
UNKNOWN STEREO
MCULE-2665134427
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 | 28 USD | 95 | 7 working days | Get Quote |
| 5 mg | 41 USD | N/A | 9 working days | Get Quote |
| 10 mg | 41 USD | N/A | 9 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.
-
1
MCULE-8927414413
- Component type: Main
-
1
MCULE-9976402631
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2665134427.sdf |
| SMILES | MCULE-2665134427.smiles |
| Standard InChI | MCULE-2665134427.inchi |
| InChIKey | MCULE-2665134427.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-896061399 | N/A | As is | in stock |
| P-904981006 | 95 | As is | by synthesis |
| P-892293752 | 95 | As is | unavailable |
| P-892246011 | 95 | As is | 92 mg |
| P-892332875 | 95 | As is | 81 mg |
| P-1271664702 | 98 | As is | in stock |
| P-867616686 | 98 | Main component | in stock |
| P-875777825 | 98 | Main component | in stock |
| P-869221492 | 95 | Main component | by resynthesis (? - ? days) |
| P-606927649 | N/A | Main component | in stock |
| P-875889976 | 98 | Main component | 50 mg |
| P-896024370 | 98 | Main component | in stock |
| P-901477348 | 95 | Main component | by synthesis |
| P-1271670234 | 98 | Main component | in stock |
| P-892885055 | 99 | Main component as a main component | in stock |
| P-890186143 | 99 | Main component as a main component | in stock |
| P-895108340 | N/A | Main component as a main component | 50 mg |
| P-889522433 | 95 | Main component as a main component | by synthesis |
| P-896540385 | 99 | Main component as a main component | in stock |
| P-869117963 | 95 | Main component as a main component | unavailable |
| P-869157645 | 95 | Main component as a main component | unavailable |
| P-888633096 | 95 | Main component as a main component | unavailable |
| P-888653673 | 95 | Main component as a main component | unavailable |
| P-1271663674 | 99 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 1129.310 |
| logP | 6.7733 |
| H-bond acceptors | 21 |
| H-bond donors | 7 |
| Rotatable bonds | 25 |
| PSA | 236.84 |
| RO5 violations | 4 |
| RO3 violations | 6 |
| Refractivity | 303.661 |
| Atoms | 160 |
| Rings | 8 |
| Heavy atoms | 81 |
| Hydrogen atoms | 79 |
| Heteroatoms | 21 |
| N/O atoms | 18 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| Chiral centers | 10 |
| R/S chiral centers | 10 |
| 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 |
