Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3583752909
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 | 17 USD | 97 | 12 working days | Get Quote |
| 5 mg | 17 USD | 97 | 12 working days | Get Quote |
| 10 mg | 17 USD | 97 | 12 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.
-
1
MCULE-6294437098
- Component type: Main
-
3
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3583752909.sdf |
| SMILES | MCULE-3583752909.smiles |
| Standard InChI | MCULE-3583752909.inchi |
| InChIKey | MCULE-3583752909.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875853894 | 97 | As is | in stock |
| P-872724671 | 98 | As is | in stock |
| P-1264047835 | 98 | As is | in stock |
| P-1270284640 | 97 | As is | in stock |
| P-851929400 | N/A | As is | in stock |
| P-619166155 | 97 | As is | 200 g |
| P-1273297595 | 95 | As is | by resynthesis (? - ? days) |
| P-864188349 | 95 | As is | in stock |
| P-616205405 | 97 | As is | 5 g |
| P-901458052 | 95 | As is | by synthesis |
| P-851204005 | 98 | As is | in stock |
| P-861432173 | 95 | As is | by synthesis |
| P-870652505 | N/A | As is | in stock |
| P-675211797 | 95 | As is | in stock |
| P-856010120 | 97 | As is | 461 mg |
| P-619671410 | 98 | As is | in stock |
| P-617401760 | 98 | As is | in stock |
| P-892286286 | 95 | As is | unavailable |
| P-869107683 | 95 | As is | 144 mg |
| P-888626719 | 95 | As is | 144 mg |
| P-906868132 | 97 | As is | by synthesis |
| P-855104046 | 90 | As is | in stock |
| P-1271670541 | 97 | As is | in stock |
| P-867396982 | 95 | Main component | by synthesis |
| P-1268876668 | 95 | Main component | by synthesis |
| P-895601691 | 95 | Main component | by synthesis |
| P-888174764 | 98 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 4 |
| Mass | 191.951 |
| logP | -0.6162 |
| H-bond acceptors | 5 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 113.13 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 15.062 |
| Atoms | 10 |
| Rings | 0 |
| Heavy atoms | 10 |
| Hydrogen atoms | 0 |
| Heteroatoms | 9 |
| N/O atoms | 5 |
| Inorganic atoms | 3 |
| 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 |
