Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3043970924
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 | N/A | 9 working days | Get Quote |
| 5 mg | 11 USD | N/A | 9 working days | Get Quote |
| 10 mg | 11 USD | N/A | 9 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-3043970924.sdf |
| SMILES | MCULE-3043970924.smiles |
| Standard InChI | MCULE-3043970924.inchi |
| InChIKey | MCULE-3043970924.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867660088 | 97 | As is | in stock |
| P-875828373 | N/A | As is | in stock |
| P-590385129 | 99 | As is | in stock |
| P-903202896 | 95 | As is | 1.175 kg |
| P-606835785 | N/A | As is | in stock |
| P-881109134 | 95 | As is | 1.25 kg |
| P-589656444 | 95 | As is | by resynthesis (? - ? days) |
| P-869407105 | 95 | As is | by synthesis |
| P-901918068 | 98 | As is | 21.265 g |
| P-868585100 | 98 | As is | in stock |
| P-905312133 | 97 | As is | 23.3 g |
| P-492228781 | 95 | As is | in stock |
| P-588709072 | 97 | As is | unavailable |
| P-856012700 | 90 | As is | unavailable |
| P-854830818 | 95 | As is | by synthesis |
| P-502383920 | 90 | As is | in stock |
| P-868522583 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 150.217 |
| logP | 2.7822 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 9.23 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 47.514 |
| Atoms | 25 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 14 |
| Heteroatoms | 1 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| 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 |
