Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9473125232
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 | 34 USD | 90 | 23 working days | Get Quote |
| 5 mg | 36 USD | 90 | 26 working days | Get Quote |
| 10 mg | 41 USD | 90 | 26 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-9473125232.sdf |
| SMILES | MCULE-9473125232.smiles |
| Standard InChI | MCULE-9473125232.inchi |
| InChIKey | MCULE-9473125232.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-892871438 | 95 | As is | in stock |
| P-889948480 | N/A | As is | by synthesis |
| P-869258778 | 95 | As is | in stock |
| P-903210837 | 95 | As is | 2.5 g |
| P-851851451 | N/A | As is | by synthesis |
| P-889798340 | 95 | As is | by synthesis |
| P-591114199 | 95 | As is | by synthesis |
| P-454688370 | 90 | As is | in stock |
| P-619314858 | 90 | As is | 39 mg |
| P-436444520 | 90 | As is | 15.7 g |
| P-347534 | 90 | As is | 237 mg |
| P-436450738 | 95 | As is | in stock |
| P-19881443 | 90 | As is | in stock |
| P-34597109 | 90 | As is | by synthesis |
| P-864497408 | 90 | As is | in stock |
| P-864497863 | 90 | As is | in stock |
| P-428629721 | 90 | As is | in stock |
| P-904200709 | 95 | As is | 1.43 g |
| P-580041808 | 90 | As is | in stock |
| P-580005783 | 95 | As is | in stock |
| P-488550034 | 90 | As is | in stock |
| P-13751074 | 92 | As is | 300 mg |
| P-596592482 | 90 | As is | 1000 mg |
| P-852405312 | N/A | As is | in stock |
| P-895660260 | 95 | As is | by synthesis |
| P-620226655 | 95 | As is | 1.43 g |
| P-674896527 | 90 | As is | 1.43 g |
| P-454371921 | 92 | As is | in stock |
| P-856072607 | 95 | As is | in stock |
| P-424838012 | 90 | As is | in stock |
| P-22627010 | 90 | As is | in stock |
| P-502341195 | 90 | As is | in stock |
| P-888482192 | 94 | As is | by resynthesis (? - ? days) |
| P-855235970 | 90 | As is | in stock |
| P-464677949 | 90 | As is | 1.862 g |
| P-1430700 | 90 | As is | 1.862 g |
| P-893842716 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 295.287 |
| logP | 1.2149 |
| H-bond acceptors | 7 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 85.3 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 77.3388 |
| Atoms | 38 |
| Rings | 2 |
| Heavy atoms | 21 |
| Hydrogen atoms | 17 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
