Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2876100010
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 | 48 USD | 90 | 22 working days | Get Quote |
| 5 mg | 71 USD | 90 | 22 working days | Get Quote |
| 10 mg | 89 USD | 90 | 22 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.
-
MCULE-4901339125
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2876100010.sdf |
| SMILES | MCULE-2876100010.smiles |
| Standard InChI | MCULE-2876100010.inchi |
| InChIKey | MCULE-2876100010.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1266161365 | 98 | As is | in stock |
| P-1265909232 | 98 | As is | in stock |
| P-1264633809 | 98 | As is | 200 mg |
| P-904327024 | 90 | As is | 1.15 g |
| P-1271992212 | 98 | As is | 300 mg |
| P-1273470580 | 95 | As is | by resynthesis (? - ? days) |
| P-905468946 | 95 | As is | in stock |
| P-1263268707 | 95 | As is | by synthesis |
| P-905412037 | 98 | As is | 600 mg |
| P-502538189 | 95 | As is | by synthesis |
| P-19445135 | 90 | As is | in stock |
| P-502383768 | 90 | As is | in stock |
| P-25054777 | 90 | As is | 113 mg |
| P-1270265077 | 95 | As a main component | in stock |
| P-1270057090 | 95 | As a main component | by synthesis |
| P-1273197556 | 95 | As a main component | 5 g |
| P-892494591 | 90 | As a main component | 3 mg |
| P-504737081 | 90 | As a main component | 5 mg |
| P-619279114 | 90 | As a main component | 1 mg |
| P-617605546 | 90 | As a main component | 287 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 205.228 |
| logP | 3.196 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 25.17 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 56.6767 |
| Atoms | 27 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 12 |
| 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 |
