Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7671419474
Compound
Show structures
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 | 97 | 14 working days | Get Quote |
| 5 mg | 6 USD | 97 | 14 working days | Get Quote |
| 10 mg | 6 USD | 97 | 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.
-
1
MCULE-8460751648
- Component type: Main
-
2
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7671419474.sdf |
| SMILES | MCULE-7671419474.smiles |
| Standard InChI | MCULE-7671419474.inchi |
| InChIKey | MCULE-7671419474.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903212808 | 97 | As is | 3.5 kg |
| P-866724899 | 95 | As is | unavailable |
| P-616205793 | 99 | As is | 2.061 kg |
| P-851204013 | 95 | As is | in stock |
| P-868595288 | 98 | As is | in stock |
| P-868661542 | 95 | As is | in stock |
| P-852459734 | N/A | As is | in stock |
| P-619671840 | 98 | As is | in stock |
| P-617401669 | N/A | As is | in stock |
| P-617404888 | N/A | As is | in stock |
| P-903057916 | 97 | Main component | 500 g |
| P-905489336 | 95 | Main component | 10 g |
| P-893553873 | 90 | Main component | 4.34706 kg |
| P-895912470 | 95 | Main component | by resynthesis (? - ? days) |
| P-580697332 | 95 | Main component | 161 g |
| P-868628774 | 95 | Main component | in stock |
| P-905326600 | 95 | Main component | 4 g |
| P-901407515 | 95 | Main component | 922.903 g |
| P-856078764 | 95 | Main component | unavailable |
| P-584614273 | 95 | Main component | in stock |
| P-878645225 | 98 | Main component | in stock |
| P-903174299 | 95 | Main component as a main component | 10 g |
| P-893449051 | 90 | Main component as a main component | 22.475 g |
| P-905588584 | 95 | Main component as a main component | by synthesis |
| P-868625970 | 95 | Main component as a main component | in stock |
| P-889440512 | N/A | Main component as a main component | 13.101 g |
| P-852466379 | N/A | Main component as a main component | in stock |
| P-872670764 | 95 | Main component as a main component | in stock |
| P-872683900 | 95 | Main component as a main component | in stock |
| P-906906513 | 95 | Main component as a main component | in stock |
| P-1262448017 | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 551.145 |
| logP | -0.1714 |
| H-bond acceptors | 18 |
| H-bond donors | 5 |
| Rotatable bonds | 8 |
| PSA | 314.22 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 92.3401 |
| Atoms | 47 |
| Rings | 3 |
| Heavy atoms | 33 |
| Hydrogen atoms | 14 |
| Heteroatoms | 23 |
| N/O atoms | 18 |
| Inorganic atoms | 2 |
| Halogen atoms | 0 |
| Chiral centers | 4 |
| R/S chiral centers | 4 |
| 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 |
