Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7404045031
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 | 14 USD | 97 | 20 working days | Get Quote |
| 5 mg | 14 USD | 97 | 20 working days | Get Quote |
| 10 mg | 14 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-7404045031.sdf |
| SMILES | MCULE-7404045031.smiles |
| Standard InChI | MCULE-7404045031.inchi |
| InChIKey | MCULE-7404045031.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875705399 | N/A | As is | in stock |
| P-869237367 | 95 | As is | in stock |
| P-903030788 | 97 | As is | 30 g |
| P-893595265 | 90 | As is | 668.993 g |
| P-851941996 | N/A | As is | in stock |
| P-865905007 | 97 | As is | 50 g |
| P-864206952 | 95 | As is | in stock |
| P-619603594 | 97 | As is | 1000 mg |
| P-10626746 | 90 | As is | 18 mg |
| P-861395933 | 95 | As is | by synthesis |
| P-580381849 | N/A | As is | by resynthesis (? - ? days) |
| P-862111024 | 95 | As is | 30.552 g |
| P-579523635 | 90 | As is | 6 g |
| P-890212432 | 90 | As is | 6 g |
| P-502529538 | 95 | As is | by synthesis |
| P-503137462 | 90 | As is | by synthesis |
| P-502670849 | 90 | As is | in stock |
| P-502674270 | 90 | As is | in stock |
| P-492237308 | 95 | As is | in stock |
| P-492238802 | 95 | As is | in stock |
| P-12581919 | 95 | As is | 300 mg |
| P-855963394 | 97 | As is | 100 mg |
| P-31187395 | 90 | As is | unavailable |
| P-601051575 | 90 | As is | 1.008 g |
| P-14056127 | 95 | As is | 1.008 g |
| P-852506848 | N/A | As is | in stock |
| P-35249787 | 90 | As is | 172 g |
| P-895220956 | 95 | As is | in stock |
| P-12354001 | 90 | As is | 1.708 g |
| P-888887663 | N/A | As is | in stock |
| P-13632638 | 92 | As is | 300 mg |
| P-856069764 | 95 | As is | in stock |
| P-18829327 | 90 | As is | in stock |
| P-18892848 | 90 | As is | in stock |
| P-873235539 | 90 | As is | in stock |
| P-22470835 | 90 | As is | 28 mg |
| P-906815868 | 97 | As is | by synthesis |
| P-611568939 | 90 | As is | in stock |
| P-2231665 | 90 | As is | 120 mg |
| P-3243378 | 90 | As is | 204 mg |
| P-893979164 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 157.196 |
| logP | 0.1952 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 83.94 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 39.3397 |
| Atoms | 17 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 7 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| 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 |
