Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9785758903
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 | 23 USD | 98 | 22 working days | Get Quote |
| 5 mg | 23 USD | 98 | 22 working days | Get Quote |
| 10 mg | 23 USD | 98 | 22 working days | Get Quote |
- 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-9785758903.sdf |
| SMILES | MCULE-9785758903.smiles |
| Standard InChI | MCULE-9785758903.inchi |
| InChIKey | MCULE-9785758903.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875787281 | 95 | As is | in stock |
| P-580454400 | 95 | As is | unavailable |
| P-1275162887 | 98 | As is | in stock |
| P-1275156529 | 95 | As is | in stock |
| P-893557518 | 90 | As is | 479 g |
| P-489193673 | 97 | As is | in stock |
| P-494350477 | 95 | As is | 1.753 g |
| P-1275501760 | 95 | As is | by resynthesis (? - ? days) |
| P-889461824 | 95 | As is | by synthesis |
| P-900267639 | N/A | As is | by resynthesis (? - ? days) |
| P-893235831 | 95 | As is | in stock |
| P-851309475 | 95 | As is | by synthesis |
| P-872749086 | 97 | As is | in stock |
| P-489246950 | 95 | As is | in stock |
| P-905359055 | 95 | As is | 12.6 g |
| P-14042344 | 90 | As is | no data |
| P-492234675 | 95 | As is | in stock |
| P-524189662 | 98 | As is | 98 mg |
| P-588717724 | 98 | As is | 98 mg |
| P-579615798 | 95 | As is | in stock |
| P-892092497 | 95 | As is | in stock |
| P-852603511 | 95 | As is | by synthesis |
| P-854691247 | 95 | As is | in stock |
| P-1275010812 | 95 | As is | in stock |
| P-872683407 | 95 | As is | in stock |
| P-888175437 | 98 | As is | by synthesis |
| P-888886046 | N/A | As is | in stock |
| P-491075071 | 95 | As is | by synthesis |
| P-869180110 | 95 | As is | in stock |
| P-892282834 | 95 | As is | 562 mg |
| P-892301716 | 95 | As is | 562 mg |
| P-892356167 | 95 | As is | 562 mg |
| P-33909569 | 90 | As is | in stock |
| P-873234452 | 90 | As is | in stock |
| P-611522359 | 90 | As is | in stock |
| P-611384187 | 90 | As is | in stock |
| P-480465259 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 224.214 |
| logP | 2.4812 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 63.08 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 64.0033 |
| Atoms | 25 |
| Rings | 3 |
| Heavy atoms | 17 |
| Hydrogen atoms | 8 |
| 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 |
