Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9698114284
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 | 6 USD | 98 | 14 working days | Get Quote |
| 5 mg | 6 USD | 98 | 14 working days | Get Quote |
| 10 mg | 6 USD | 98 | 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.
| Name | File |
|---|---|
| SDF | MCULE-9698114284.sdf |
| SMILES | MCULE-9698114284.smiles |
| Standard InChI | MCULE-9698114284.inchi |
| InChIKey | MCULE-9698114284.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867543948 | 98 | As is | in stock |
| P-875700839 | N/A | As is | in stock |
| P-881672916 | 98 | As is | in stock |
| P-579762013 | 99 | As is | in stock |
| P-903024611 | 98 | As is | 1.5 kg |
| P-905488071 | 98 | As is | 100 g |
| P-606859493 | N/A | As is | in stock |
| P-596939046 | 98 | As is | 921.41 g |
| P-494429200 | 95 | As is | by resynthesis (? - ? days) |
| P-864144853 | 95 | As is | in stock |
| P-580702889 | 98 | As is | 680 g |
| P-900268180 | N/A | As is | by resynthesis (? - ? days) |
| P-893228042 | 95 | As is | in stock |
| P-3282078 | 90 | As is | 100 mg |
| P-425203126 | 90 | As is | in stock |
| P-868599197 | 98 | As is | in stock |
| P-580443031 | 95 | As is | by resynthesis (? - ? days) |
| P-905351681 | 95 | As is | 335 g |
| P-862093159 | 95 | As is | 1.0824 kg |
| P-870657552 | N/A | As is | in stock |
| P-502528255 | 95 | As is | by synthesis |
| P-856009571 | 97 | As is | 100 mg |
| P-31256473 | 90 | As is | unavailable |
| P-860794943 | N/A | As is | by synthesis |
| P-854712076 | 95 | As is | in stock |
| P-619673521 | 98 | As is | in stock |
| P-674896400 | 90 | As is | 50 mg |
| P-889869965 | 95 | As is | by synthesis |
| P-19674011 | 90 | As is | in stock |
| P-617402762 | N/A | As is | in stock |
| P-896078251 | N/A | As is | 480 mg |
| P-594274981 | 95 | As is | by synthesis |
| P-892296315 | 95 | As is | 1.003 g |
| P-888657062 | 95 | As is | 1.003 g |
| P-33715271 | 94 | As is | by resynthesis (? - ? days) |
| P-906758807 | 98 | As is | by synthesis |
| P-611485066 | 90 | As is | in stock |
| P-424766710 | 90 | As is | 1000 mg |
| P-615398514 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 270.279 |
| logP | 2.7694 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 5 |
| PSA | 52.6 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 74.529 |
| Atoms | 34 |
| Rings | 2 |
| Heavy atoms | 20 |
| Hydrogen atoms | 14 |
| Heteroatoms | 4 |
| 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 |
