Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4197149171
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 | 5 USD | 99 | 14 working days | Get Quote |
| 5 mg | 5 USD | 99 | 14 working days | Get Quote |
| 10 mg | 5 USD | 99 | 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.
-
MCULE-3509986181
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4197149171.sdf |
| SMILES | MCULE-4197149171.smiles |
| Standard InChI | MCULE-4197149171.inchi |
| InChIKey | MCULE-4197149171.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867587925 | 97 | As is | in stock |
| P-875747055 | N/A | As is | in stock |
| P-869186869 | 95 | As is | in stock |
| P-505398642 | 98 | As is | in stock |
| P-903077809 | 99 | As is | 300 g |
| P-905478901 | 97 | As is | 100 g |
| P-606839779 | N/A | As is | in stock |
| P-489123801 | 97 | As is | in stock |
| P-596931714 | 99 | As is | 1000 g |
| P-494332075 | 95 | As is | by resynthesis (? - ? days) |
| P-864095779 | 99 | As is | in stock |
| P-481171514 | 95 | As is | 25 g |
| P-580721569 | 97 | As is | 641 g |
| P-454625903 | 90 | As is | in stock |
| P-436461221 | 95 | As is | 5 g |
| P-851270427 | 95 | As is | by synthesis |
| P-861276528 | 95 | As is | in stock |
| P-868639911 | 98 | As is | in stock |
| P-580287893 | N/A | As is | by resynthesis (? - ? days) |
| P-861981748 | 98 | As is | 53 g |
| P-905335989 | 98 | As is | 53 g |
| P-505494556 | 95 | As is | in stock |
| P-504608768 | 90 | As is | by synthesis |
| P-454352903 | 97 | As is | 100 mg |
| P-454417381 | 97 | As is | 10 g |
| P-615643349 | 95 | As is | in stock |
| P-579624947 | 98 | As is | 50 g |
| P-856042027 | 90 | As is | 2 g |
| P-31219110 | 90 | As is | 2 g |
| P-613283692 | 95 | As is | by synthesis |
| P-580472849 | N/A | As is | by synthesis |
| P-852432473 | N/A | As is | in stock |
| P-428003267 | 90 | As is | 144 kg |
| P-854754003 | 95 | As is | in stock |
| P-26433709 | 90 | As is | 116 mg |
| P-579717474 | N/A | As is | in stock |
| P-888862187 | N/A | As is | in stock |
| P-500403041 | 98 | As is | by synthesis |
| P-889879181 | 95 | As is | by synthesis |
| P-896082128 | N/A | As is | 9.476 g |
| P-498711734 | 97 | As is | 1.3265 kg |
| P-502362009 | 90 | As is | in stock |
| P-906775871 | 97 | As is | by synthesis |
| P-855246866 | 90 | As is | in stock |
| P-615393127 | 95 | As is | in stock |
| P-886801590 | 95 | As a main component | in stock |
| P-890082504 | N/A | As a main component | by synthesis |
| P-903417658 | 95 | As a main component | 1000 mg |
| P-1263098472 | N/A | As a main component | by synthesis |
| P-905577576 | 95 | As a main component | by synthesis |
| P-861386349 | 95 | As a main component | by synthesis |
| P-893820826 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 138.124 |
| logP | 0.2632 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 52.08 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 33.3115 |
| Atoms | 16 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 6 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
