Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4323937320
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 | 7 USD | 97 | 20 working days | Get Quote |
| 5 mg | 7 USD | 97 | 20 working days | Get Quote |
| 10 mg | 7 USD | 97 | 20 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.
| Name | File |
|---|---|
| SDF | MCULE-4323937320.sdf |
| SMILES | MCULE-4323937320.smiles |
| Standard InChI | MCULE-4323937320.inchi |
| InChIKey | MCULE-4323937320.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867640422 | 97 | As is | in stock |
| P-875806278 | 97 | As is | in stock |
| P-1275166043 | 99 | As is | in stock |
| P-1270400485 | 97 | As is | in stock |
| P-606884066 | N/A | As is | in stock |
| P-489201305 | 97 | As is | in stock |
| P-596985519 | 97 | As is | 400 g |
| P-1273454945 | 95 | As is | by resynthesis (? - ? days) |
| P-864138242 | 95 | As is | in stock |
| P-580703929 | 97 | As is | 273 g |
| P-851280189 | 95 | As is | by synthesis |
| P-868606808 | 97 | As is | in stock |
| P-862048131 | 95 | As is | 548.966 g |
| P-1264354707 | 95 | As is | 2 g |
| P-860792804 | N/A | As is | by synthesis |
| P-868744012 | 95 | As is | in stock |
| P-896070261 | 95 | As is | in stock |
| P-878646635 | 98 | As is | in stock |
| P-885547223 | 95 | As is | by synthesis |
| P-596765476 | 97 | As is | 189.7 g |
| P-892289835 | 95 | As is | unavailable |
| P-869121528 | 95 | As is | 200 mg |
| P-888636157 | 95 | As is | 200 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 281.347 |
| logP | 2.4448 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 11 |
| PSA | 74.68 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 80.6138 |
| Atoms | 43 |
| Rings | 1 |
| Heavy atoms | 20 |
| Hydrogen atoms | 23 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
