Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3647517038
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 | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 29 USD | 92 | 18 working days | Get Quote |
| 10 mg | 36 USD | 92 | 18 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-2055603903
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3647517038.sdf |
| SMILES | MCULE-3647517038.smiles |
| Standard InChI | MCULE-3647517038.inchi |
| InChIKey | MCULE-3647517038.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867561107 | 95 | As is | in stock |
| P-875720767 | N/A | As is | in stock |
| P-590417852 | 95 | As is | in stock |
| P-903049844 | 98 | As is | 15 g |
| P-893593828 | 90 | As is | 15 g |
| P-851949385 | N/A | As is | in stock |
| P-596945211 | 95 | As is | 15 g |
| P-864192006 | 95 | As is | in stock |
| P-893222776 | 95 | As is | in stock |
| P-577175925 | 90 | As is | by synthesis |
| P-317352 | 90 | As is | 74 mg |
| P-861271629 | 95 | As is | in stock |
| P-868621790 | 95 | As is | in stock |
| P-34825222 | 90 | As is | in stock |
| P-870653834 | 97 | As is | in stock |
| P-675216409 | 95 | As is | in stock |
| P-502565108 | 95 | As is | by synthesis |
| P-488543958 | 90 | As is | in stock |
| P-12387755 | 95 | As is | 300 mg |
| P-855982477 | 95 | As is | 250 mg |
| P-852462292 | N/A | As is | in stock |
| P-888843416 | N/A | As is | by synthesis |
| P-13881272 | 92 | As is | 300 mg |
| P-885544557 | 95 | As is | by synthesis |
| P-519900124 | 90 | As is | in stock |
| P-24111031 | 90 | As is | in stock |
| P-22531112 | 90 | As is | 7 mg |
| P-611389682 | 90 | As is | in stock |
| P-2141210 | 90 | As is | 78 mg |
| P-2396271 | 90 | As is | 59 mg |
| P-615411370 | 95 | As is | in stock |
| P-1263087427 | N/A | As a main component | by synthesis |
| P-905541829 | 95 | As a main component | by synthesis |
| P-893720039 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 230.023 |
| logP | 0.9844 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 0 |
| PSA | 100.71 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 45.8111 |
| Atoms | 16 |
| Rings | 2 |
| Heavy atoms | 12 |
| Hydrogen atoms | 4 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| 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 |
