MCULE-7150737041
- 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 | 125 USD | N/A | 17 working days | Get Quote |
| 5 mg | 125 USD | N/A | 17 working days | Get Quote |
| 10 mg | 125 USD | N/A | 17 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.
-
MCULE-8237848448
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-7150737041.sdf |
| SMILES | MCULE-7150737041.smiles |
| Standard InChI | MCULE-7150737041.inchi |
| InChIKey | MCULE-7150737041.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886628796 | 95 | As is | in stock |
| P-889934515 | N/A | As is | by synthesis |
| P-869224911 | 95 | As is | in stock |
| P-903173520 | 95 | As is | 10 g |
| P-851910937 | N/A | As is | by synthesis |
| P-596517958 | 90 | As is | unavailable |
| P-889805179 | 95 | As is | by synthesis |
| P-591113183 | 95 | As is | by synthesis |
| P-901554820 | 95 | As is | by synthesis |
| P-895629281 | 95 | As is | by synthesis |
| P-893748982 | 95 | As is | by synthesis |
| P-867461469 | N/A | As a main component | by synthesis |
| P-615710965 | 95 | As a main component | in stock |
| P-851749537 | N/A | As a main component | by synthesis |
| P-892496524 | 90 | As a main component | 1000 mg |
| P-590944476 | 97 | As a main component | by synthesis |
| P-852402740 | N/A | As a main component | in stock |
| P-869075594 | 95 | As a main component | by synthesis |
| P-873237219 | 90 | As a main component | in stock |
| P-903664575 | 94 | As a main component | by resynthesis (? - ? days) |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 189.296 |
| logP | 3.4469 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 26.02 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 60.8434 |
| Atoms | 33 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 19 |
| Heteroatoms | 1 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 2 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |

