Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2205995654
Compound
Show structures
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 | 29 USD | 95 | 20 working days | Get Quote |
| 5 mg | 29 USD | 95 | 20 working days | Get Quote |
| 10 mg | 29 USD | 95 | 20 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 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-7435519723
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2205995654.sdf |
| SMILES | MCULE-2205995654.smiles |
| Standard InChI | MCULE-2205995654.inchi |
| InChIKey | MCULE-2205995654.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867609380 | 98 | As is | in stock |
| P-875768950 | N/A | As is | in stock |
| P-869188663 | 95 | As is | in stock |
| P-869217891 | 98 | As is | in stock |
| P-613854323 | 98 | As is | in stock |
| P-903107784 | 95 | As is | 9 g |
| P-893302204 | N/A | As is | in stock |
| P-606848331 | N/A | As is | in stock |
| P-851151428 | 95 | As is | 60 g |
| P-901328976 | 98 | As is | in stock |
| P-864184186 | 95 | As is | in stock |
| P-580713833 | 95 | As is | 6.5 g |
| P-901455486 | 95 | As is | by synthesis |
| P-851271959 | 95 | As is | by synthesis |
| P-500144004 | 95 | As is | in stock |
| P-860785642 | 98 | As is | in stock |
| P-860785643 | 98 | As is | in stock |
| P-860785644 | 98 | As is | in stock |
| P-868629278 | 97 | As is | in stock |
| P-905430670 | 95 | As is | 72.036 g |
| P-855924943 | 95 | As is | 10 g |
| P-856082127 | 95 | As is | by resynthesis (? - ? days) |
| P-899991105 | 95 | As is | by synthesis |
| P-863725379 | 95 | As is | in stock |
| P-596861047 | 95 | As is | by synthesis |
| P-906797868 | 95 | As is | by synthesis |
| P-611445313 | 90 | As is | in stock |
| P-615459371 | 95 | As is | in stock |
| P-855911958 | 95 | As a main component | 50 mg |
| P-852657102 | N/A | As a main component | in stock |
| P-611520802 | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 460.552 |
| logP | 2.6162 |
| H-bond acceptors | 10 |
| H-bond donors | 2 |
| Rotatable bonds | 7 |
| PSA | 130.59 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 129.6544 |
| Atoms | 60 |
| Rings | 4 |
| Heavy atoms | 32 |
| Hydrogen atoms | 28 |
| Heteroatoms | 11 |
| N/O atoms | 10 |
| 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 |
