MCULE-9621821437
- 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 | 7 USD | 98 | 14 working days | Get Quote |
| 5 mg | 7 USD | 98 | 14 working days | Get Quote |
| 10 mg | 7 USD | 98 | 14 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.
-
1
MCULE-9858917034
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-9621821437.sdf |
| SMILES | MCULE-9621821437.smiles |
| Standard InChI | MCULE-9621821437.inchi |
| InChIKey | MCULE-9621821437.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-901567819 | 95 | As is | by synthesis |
| P-855955563 | 95 | As is | 1000 mg |
| P-893771848 | 95 | As is | by synthesis |
| P-867568407 | 96 | Main component | in stock |
| P-875727791 | N/A | Main component | in stock |
| P-590389737 | 95 | Main component | in stock |
| P-903056981 | 98 | Main component | 90 g |
| P-610975709 | 90 | Main component | 230.998 g |
| P-580242551 | 95 | Main component | by synthesis |
| P-606939770 | N/A | Main component | in stock |
| P-489236079 | 97 | Main component | in stock |
| P-596948114 | 98 | Main component | 30 g |
| P-494311282 | 95 | Main component | by resynthesis (? - ? days) |
| P-864104702 | 95 | Main component | in stock |
| P-580733320 | 97 | Main component | 1000 mg |
| P-577179353 | 90 | Main component | by synthesis |
| P-851287352 | 95 | Main component | by synthesis |
| P-868595544 | 97 | Main component | in stock |
| P-861925892 | 95 | Main component | 8.5 g |
| P-905329071 | 95 | Main component | 8.5 g |
| P-619803935 | 96 | Main component | in stock |
| P-870640817 | 95 | Main component | 100 mg |
| P-18803123 | 95 | Main component | 15.733 g |
| P-588714002 | 95 | Main component | 1000 mg |
| P-596577205 | 95 | Main component | 1000 mg |
| P-454397695 | 95 | Main component | 25 g |
| P-579675739 | 95 | Main component | by resynthesis (? - ? days) |
| P-588254729 | N/A | Main component | by synthesis |
| P-852414147 | N/A | Main component | in stock |
| P-854757177 | 95 | Main component | in stock |
| P-885548083 | 95 | Main component | by synthesis |
| P-23845143 | 90 | Main component | in stock |
| P-502404542 | 90 | Main component | in stock |
| P-611371965 | 90 | Main component | in stock |
| P-3242623 | 90 | Main component | 16 mg |
| P-718226 | 90 | Main component | 16 mg |
| P-615451054 | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 269.646 |
| logP | 3.6822 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 63.32 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 57.4682 |
| Atoms | 28 |
| Rings | 1 |
| Heavy atoms | 17 |
| Hydrogen atoms | 11 |
| Heteroatoms | 7 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 4 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |

