Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4890501318
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 | 39 USD | 90 | 22 working days | Get Quote |
| 5 mg | 57 USD | 90 | 22 working days | Get Quote |
| 10 mg | 72 USD | 90 | 22 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-6786004497
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4890501318.sdf |
| SMILES | MCULE-4890501318.smiles |
| Standard InChI | MCULE-4890501318.inchi |
| InChIKey | MCULE-4890501318.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-852079082 | N/A | As is | by synthesis |
| P-875755263 | N/A | As is | in stock |
| P-590357490 | 95 | As is | in stock |
| P-489108602 | 97 | As is | in stock |
| P-596514894 | 90 | As is | unavailable |
| P-851293070 | 95 | As is | by synthesis |
| P-580409285 | 95 | As is | by resynthesis (? - ? days) |
| P-500154391 | 96 | As is | in stock |
| P-852386237 | N/A | As is | in stock |
| P-896075364 | N/A | As is | 11 mg |
| P-855224480 | 90 | As is | in stock |
| P-1866045 | 90 | As is | 110 mg |
| P-615462174 | 95 | As is | in stock |
| P-852199747 | N/A | As a main component | by synthesis |
| P-615711856 | 95 | As a main component | in stock |
| P-892488671 | 90 | As a main component | 1000 mg |
| P-901438582 | 95 | As a main component | by synthesis |
| P-619322889 | 90 | As a main component | 30 mg |
| P-617323450 | 90 | As a main component | in stock |
| P-851293069 | 95 | As a main component | by synthesis |
| P-34677475 | 90 | As a main component | by synthesis |
| P-500154392 | 96 | As a main component | in stock |
| P-852401869 | N/A | As a main component | in stock |
| P-675098373 | 90 | As a main component | in stock |
| P-873214862 | 90 | As a main component | in stock |
| P-899594841 | 90 | As a main component | 79 mg |
| P-855235479 | 90 | As a main component | in stock |
| P-615462019 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 256.728 |
| logP | 3.8234 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 17.82 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 75.244 |
| Atoms | 31 |
| Rings | 3 |
| Heavy atoms | 18 |
| Hydrogen atoms | 13 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
