MCULE-6736577438
- 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 | 75 USD | 97 | 15 working days | Get Quote |
| 5 mg | 75 USD | 97 | 15 working days | Get Quote |
| 10 mg | 75 USD | 97 | 15 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-6736577438.sdf |
| SMILES | MCULE-6736577438.smiles |
| Standard InChI | MCULE-6736577438.inchi |
| InChIKey | MCULE-6736577438.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867643299 | 97 | As is | in stock |
| P-875809684 | N/A | As is | in stock |
| P-869246916 | 95 | As is | in stock |
| P-903169750 | 97 | As is | 4 g |
| P-893595085 | 90 | As is | 4 g |
| P-851951296 | N/A | As is | in stock |
| P-865922944 | 97 | As is | 4 g |
| P-864206921 | 95 | As is | in stock |
| P-616205297 | 97 | As is | 2.17 g |
| P-901555884 | 95 | As is | by synthesis |
| P-870587994 | 95 | As is | by synthesis |
| P-855375243 | 90 | As is | in stock |
| P-502554283 | 95 | As is | by synthesis |
| P-855962752 | 97 | As is | 1000 mg |
| P-854798773 | 95 | As is | by synthesis |
| P-888892271 | N/A | As is | in stock |
| P-491122915 | 95 | As is | by synthesis |
| P-868510409 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 151.166 |
| logP | 0.9955 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 68.01 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 41.6376 |
| Atoms | 20 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 9 |
| 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 |

