Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1279275017
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 | 11 USD | 98 | 20 working days | Get Quote |
| 5 mg | 11 USD | 98 | 20 working days | Get Quote |
| 10 mg | 11 USD | 98 | 20 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.
-
1
MCULE-3180289877
- Component type: Main
-
4
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1279275017.sdf |
| SMILES | MCULE-1279275017.smiles |
| Standard InChI | MCULE-1279275017.inchi |
| InChIKey | MCULE-1279275017.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886640523 | N/A | As is | in stock |
| P-875824457 | N/A | As is | in stock |
| P-903196131 | N/A | As is | 100 g |
| P-873297051 | N/A | As is | 200 g |
| P-864125599 | 97 | As is | in stock |
| P-868630380 | 97 | As is | in stock |
| P-893976187 | 95 | As is | in stock |
| P-867585272 | 98 | Main component | in stock |
| P-875743273 | N/A | Main component | in stock |
| P-869183137 | 95 | Main component | in stock |
| P-505348221 | 98 | Main component | in stock |
| P-903073473 | 98 | Main component | 200 g |
| P-1264058871 | 95 | Main component | in stock |
| P-905488284 | 95 | Main component | 10 g |
| P-893291649 | N/A | Main component | in stock |
| P-596983910 | 98 | Main component | 165 g |
| P-872728191 | 98 | Main component | in stock |
| P-864196157 | 95 | Main component | in stock |
| P-500413874 | 95 | Main component | by synthesis |
| P-901493074 | 95 | Main component | by synthesis |
| P-893221911 | 95 | Main component | in stock |
| P-868595101 | 98 | Main component | in stock |
| P-862033065 | 95 | Main component | 115 g |
| P-870652126 | N/A | Main component | in stock |
| P-502447584 | 95 | Main component | by synthesis |
| P-502596293 | 90 | Main component | in stock |
| P-524162004 | 95 | Main component | 25 g |
| P-852468165 | N/A | Main component | in stock |
| P-854720028 | 95 | Main component | in stock |
| P-584614509 | 95 | Main component | in stock |
| P-619673873 | 98 | Main component | in stock |
| P-500377529 | 98 | Main component | by synthesis |
| P-885550520 | 95 | Main component | by synthesis |
| P-617403001 | N/A | Main component | in stock |
| P-869162853 | 95 | Main component | by synthesis |
| P-892298710 | 95 | Main component | unavailable |
| P-888658322 | 95 | Main component | 126 mg |
| P-33815345 | 90 | Main component | in stock |
| P-907190006 | 94 | Main component | by resynthesis (? - ? days) |
| P-611530158 | 90 | Main component | in stock |
| P-611350504 | 90 | Main component | in stock |
| P-872942964 | N/A | Main component as a main component | in stock |
| P-889789675 | 95 | Main component as a main component | in stock |
| P-872931981 | 95 | Main component as a main component | 30 g |
| P-619928912 | 90 | Main component as a main component | by synthesis |
| P-617651348 | 90 | Main component as a main component | in stock |
| P-617328462 | 95 | Main component as a main component | in stock |
| P-868633017 | 98 | Main component as a main component | in stock |
| P-862073900 | N/A | Main component as a main component | 2 g |
| P-675500965 | 95 | Main component as a main component | in stock |
| P-675504451 | 95 | Main component as a main component | in stock |
| P-617806391 | 90 | Main component as a main component | in stock |
| P-617974102 | 95 | Main component as a main component | 300 mg |
| P-856010089 | 97 | Main component as a main component | 558 mg |
| P-856080258 | 99 | Main component as a main component | by resynthesis (? - ? days) |
| P-852416704 | N/A | Main component as a main component | in stock |
| P-650817348 | 90 | Main component as a main component | by synthesis |
| P-674717942 | 92 | Main component as a main component | in stock |
| P-674439628 | 92 | Main component as a main component | 300 mg |
| P-1263957201 | 90 | Main component as a main component | in stock |
| P-855141097 | 90 | Main component as a main component | in stock |
| P-617714792 | 90 | Main component as a main component | 1.003 g |
| P-617781434 | 90 | Main component as a main component | 1.003 g |
| Property | Value |
|---|---|
| Components | 5 |
| Mass | 337.023 |
| logP | 1.1799 |
| H-bond acceptors | 8 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 192.25 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 41.0942 |
| Atoms | 27 |
| Rings | 0 |
| Heavy atoms | 18 |
| Hydrogen atoms | 9 |
| Heteroatoms | 14 |
| N/O atoms | 8 |
| Inorganic atoms | 4 |
| 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 |
