Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5674946137-0
Structure
Show compound
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 | 97 | 20 working days | Get Quote |
| 5 mg | 7 USD | 97 | 20 working days | Get Quote |
| 10 mg | 7 USD | 97 | 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.
| Name | File |
|---|---|
| SDF | MCULE-5674946137-0.sdf |
| SMILES | MCULE-5674946137-0.smiles |
| Standard InChI | MCULE-5674946137-0.inchi |
| InChIKey | MCULE-5674946137-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-505350010 | 97 | As is | in stock |
| P-869195051 | 95 | As is | in stock |
| P-611624114 | 98 | As is | in stock |
| P-610952557 | 90 | As is | 3.76612 kg |
| P-580239614 | 95 | As is | by synthesis |
| P-617053507 | 95 | As is | by resynthesis (? - ? days) |
| P-606904909 | N/A | As is | in stock |
| P-489136822 | 97 | As is | in stock |
| P-596953815 | 97 | As is | 1000 g |
| P-494351841 | 95 | As is | 5.4 g |
| P-864092134 | 97 | As is | in stock |
| P-505593724 | 97 | As is | in stock |
| P-851238847 | 95 | As is | by synthesis |
| P-861270972 | 95 | As is | in stock |
| P-868647949 | 98 | As is | in stock |
| P-580435816 | 95 | As is | by resynthesis (? - ? days) |
| P-861988346 | 95 | As is | 1.48086 kg |
| P-905338747 | 95 | As is | 51 g |
| P-675213948 | 95 | As is | in stock |
| P-18809802 | 95 | As is | 6.144 g |
| P-454411340 | 95 | As is | 100 g |
| P-608097231 | 95 | As is | 500 g |
| P-580514626 | 95 | As is | 524 g |
| P-852427576 | N/A | As is | in stock |
| P-854734119 | 95 | As is | in stock |
| P-579714988 | N/A | As is | in stock |
| P-888857689 | N/A | As is | in stock |
| P-500412295 | 95 | As is | by synthesis |
| P-889871131 | 95 | As is | by synthesis |
| P-498669735 | 97 | As is | 4.33551 kg |
| P-666972828 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 232.464 |
| logP | 2.3738 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 41.57 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 46.5987 |
| Atoms | 14 |
| Rings | 2 |
| Heavy atoms | 11 |
| Hydrogen atoms | 3 |
| Heteroatoms | 5 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
