Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3061586810
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 | 7 USD | 98 | 14 working days | Get Quote |
| 5 mg | 7 USD | 98 | 14 working days | Get Quote |
| 10 mg | 7 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-3061586810.sdf |
| SMILES | MCULE-3061586810.smiles |
| Standard InChI | MCULE-3061586810.inchi |
| InChIKey | MCULE-3061586810.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867576450 | 99 | As is | in stock |
| P-875736966 | N/A | As is | in stock |
| P-590393427 | 95 | As is | in stock |
| P-903066755 | 98 | As is | 400 g |
| P-905476841 | 98 | As is | 10 g |
| P-893503072 | 90 | As is | 820.063 g |
| P-580241195 | 95 | As is | by synthesis |
| P-868962834 | N/A | As is | in stock |
| P-489186636 | 97 | As is | in stock |
| P-597002643 | 98 | As is | 200 g |
| P-494322958 | 95 | As is | 165.55 g |
| P-864103207 | 95 | As is | in stock |
| P-869376041 | 98 | As is | 6 g |
| P-851272127 | 95 | As is | by synthesis |
| P-861280767 | 97 | As is | in stock |
| P-868642665 | 95 | As is | in stock |
| P-580420823 | 95 | As is | by resynthesis (? - ? days) |
| P-861932597 | 99 | As is | 379.477 g |
| P-905329992 | 99 | As is | 1000 mg |
| P-505535187 | 95 | As is | in stock |
| P-18810622 | 97 | As is | 297 mg |
| P-454401719 | 97 | As is | 500 mg |
| P-579634470 | 98 | As is | by resynthesis (? - ? days) |
| P-580472009 | 95 | As is | by synthesis |
| P-852385016 | N/A | As is | in stock |
| P-854732920 | 95 | As is | in stock |
| P-885532824 | 95 | As is | by synthesis |
| P-596773450 | 95 | As is | 92 g |
| P-502396514 | 90 | As is | in stock |
| P-906906217 | 99 | As is | in stock |
| P-611489997 | 90 | As is | in stock |
| P-615391669 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 189.210 |
| logP | 2.4734 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 68.54 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 43.8984 |
| Atoms | 20 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 8 |
| Heteroatoms | 5 |
| N/O atoms | 3 |
| 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 |
