Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4777788873
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 | 36 USD | 95 | 26 working days | Get Quote |
| 5 mg | 36 USD | 95 | 26 working days | Get Quote |
| 10 mg | 36 USD | 95 | 10 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-5659975243
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4777788873.sdf |
| SMILES | MCULE-4777788873.smiles |
| Standard InChI | MCULE-4777788873.inchi |
| InChIKey | MCULE-4777788873.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-851726621 | N/A | As is | by synthesis |
| P-596496793 | 90 | As is | unavailable |
| P-864213239 | 95 | As is | by synthesis |
| P-590909034 | 95 | As is | by synthesis |
| P-868623033 | 98 | As is | in stock |
| P-590344037 | 90 | As is | 20 mg |
| P-502530317 | 95 | As is | by synthesis |
| P-563470559 | 95 | As is | 10 g |
| P-895666840 | 95 | As is | by synthesis |
| P-859997065 | 95 | As is | by synthesis |
| P-519990807 | 90 | As is | in stock |
| P-611485686 | 90 | As is | in stock |
| P-901264636 | N/A | As a main component | in stock |
| P-613855896 | 95 | As a main component | in stock |
| P-904628988 | 95 | As a main component | in stock |
| P-903120155 | 95 | As a main component | 5 g |
| P-851517548 | N/A | As a main component | by synthesis |
| P-892490495 | 90 | As a main component | 1000 mg |
| P-611044657 | 98 | As a main component | by synthesis |
| P-616226228 | 95 | As a main component | in stock |
| P-4143087 | 90 | As a main component | 100 mg |
| P-617651122 | 90 | As a main component | in stock |
| P-584600514 | 95 | As a main component | 3 g |
| P-861526530 | 95 | As a main component | by synthesis |
| P-25839885 | 95 | As a main component | 190 mg |
| P-601050848 | 90 | As a main component | 190 mg |
| P-852429009 | N/A | As a main component | in stock |
| P-895262579 | 95 | As a main component | by synthesis |
| P-903664565 | 94 | As a main component | by resynthesis (? - ? days) |
| P-855252711 | 90 | As a main component | in stock |
| P-893727214 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 206.241 |
| logP | 1.5245 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 55.56 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 60.4834 |
| Atoms | 29 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 14 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
