Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6104866282
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 | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 29 USD | 92 | 18 working days | Get Quote |
| 10 mg | 36 USD | 92 | 18 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-6104866282.sdf |
| SMILES | MCULE-6104866282.smiles |
| Standard InChI | MCULE-6104866282.inchi |
| InChIKey | MCULE-6104866282.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886531223 | 95 | As is | in stock |
| P-889902617 | N/A | As is | by synthesis |
| P-613849335 | 95 | As is | in stock |
| P-903034604 | 95 | As is | 1000 mg |
| P-907501813 | 90 | As is | by synthesis |
| P-851465031 | N/A | As is | by synthesis |
| P-489222396 | 97 | As is | in stock |
| P-589661271 | 95 | As is | by resynthesis (? - ? days) |
| P-864220023 | 95 | As is | by synthesis |
| P-590823767 | 95 | As is | by synthesis |
| P-492253905 | 95 | As is | in stock |
| P-4145994 | 90 | As is | 100 mg |
| P-619934216 | 90 | As is | by synthesis |
| P-436458895 | 95 | As is | 10 g |
| P-861498940 | 95 | As is | by synthesis |
| P-502530095 | 95 | As is | by synthesis |
| P-13877255 | 90 | As is | in stock |
| P-13846130 | 95 | As is | 300 mg |
| P-563523604 | 95 | As is | 10 g |
| P-468039099 | 95 | As is | 187 mg |
| P-14440777 | 90 | As is | 187 mg |
| P-852430837 | N/A | As is | in stock |
| P-895260796 | 95 | As is | by synthesis |
| P-454373878 | 92 | As is | in stock |
| P-14038646 | 92 | As is | 300 mg |
| P-885517115 | 95 | As is | by synthesis |
| P-424849140 | 90 | As is | in stock |
| P-896084543 | N/A | As is | 1.988 g |
| P-873226637 | 90 | As is | in stock |
| P-611590954 | 90 | As is | in stock |
| P-25508873 | 90 | As is | 1.109 g |
| P-464683211 | 90 | As is | 1.109 g |
| P-893751265 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 195.604 |
| logP | 2.5534 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 64.94 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 49.1484 |
| Atoms | 19 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 6 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
