Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3535606082-0
Structure
Show compound
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 | 6 USD | 98 | 14 working days | Get Quote |
| 5 mg | 6 USD | 98 | 14 working days | Get Quote |
| 10 mg | 6 USD | 98 | 14 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.
| Name | File |
|---|---|
| SDF | MCULE-3535606082-0.sdf |
| SMILES | MCULE-3535606082-0.smiles |
| Standard InChI | MCULE-3535606082-0.inchi |
| InChIKey | MCULE-3535606082-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867563298 | 98 | As is | in stock |
| P-875722864 | N/A | As is | in stock |
| P-590366861 | 98 | As is | in stock |
| P-903052352 | 98 | As is | 400 g |
| P-893522117 | 90 | As is | 1.59049 kg |
| P-901165365 | 98 | As is | in stock |
| P-606948514 | N/A | As is | in stock |
| P-489174160 | 97 | As is | in stock |
| P-596945996 | 98 | As is | 500 g |
| P-494331986 | 95 | As is | by resynthesis (? - ? days) |
| P-869990818 | 90 | As is | 1000 mg |
| P-864089939 | 95 | As is | in stock |
| P-1263662940 | 95 | As is | in stock |
| P-868645649 | 98 | As is | in stock |
| P-580422962 | 95 | As is | by resynthesis (? - ? days) |
| P-579719814 | N/A | As is | by resynthesis (? - ? days) |
| P-905329470 | 97 | As is | 6 g |
| P-861928048 | 97 | As is | 191.569 g |
| P-502451372 | 95 | As is | by synthesis |
| P-492229707 | 95 | As is | in stock |
| P-488543203 | 90 | As is | in stock |
| P-454349954 | 95 | As is | 194 mg |
| P-454416397 | 95 | As is | 5 g |
| P-579623424 | 95 | As is | 50 g |
| P-613284506 | 95 | As is | by synthesis |
| P-852383613 | N/A | As is | in stock |
| P-855397291 | 95 | As is | in stock |
| P-13010713 | 90 | As is | 1.5 g |
| P-492286198 | 99 | As is | 1.5 g |
| P-454363891 | 92 | As is | in stock |
| P-885517021 | 95 | As is | by synthesis |
| P-596771992 | 98 | As is | 57.5 g |
| P-502330194 | 90 | As is | in stock |
| P-22496324 | 90 | As is | 896 mg |
| P-906905972 | 98 | As is | in stock |
| P-611388799 | 90 | As is | in stock |
| P-615404088 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 140.136 |
| logP | 1.2968 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 50.44 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 35.0598 |
| Atoms | 18 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 8 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
