MCULE-8414027389-0
- 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 | 5 USD | 97 | 14 working days | Get Quote |
| 5 mg | 5 USD | 97 | 14 working days | Get Quote |
| 10 mg | 5 USD | 97 | 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.
| Name | File |
|---|---|
| SDF | MCULE-8414027389-0.sdf |
| SMILES | MCULE-8414027389-0.smiles |
| Standard InChI | MCULE-8414027389-0.inchi |
| InChIKey | MCULE-8414027389-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867564478 | 98 | As is | in stock |
| P-875723938 | N/A | As is | in stock |
| P-597020430 | 97 | As is | in stock |
| P-597022946 | 95 | As is | in stock |
| P-853444533 | 97 | As is | in stock |
| P-881663067 | 95 | As is | in stock |
| P-590392067 | 98 | As is | in stock |
| P-903053267 | 97 | As is | 1000 g |
| P-905482682 | 98 | As is | 1000 g |
| P-580198683 | 95 | As is | 1000 mg |
| P-580215007 | 95 | As is | by synthesis |
| P-617049183 | 95 | As is | by resynthesis (? - ? days) |
| P-606936256 | N/A | As is | in stock |
| P-489140365 | 97 | As is | in stock |
| P-596928659 | 98 | As is | 700 g |
| P-494374614 | 95 | As is | by resynthesis (? - ? days) |
| P-864097706 | 95 | As is | in stock |
| P-580729004 | 97 | As is | 172.25 g |
| P-505576700 | 98 | As is | in stock |
| P-505605243 | 95 | As is | by synthesis |
| P-851240937 | 95 | As is | by synthesis |
| P-861088406 | 95 | As is | in stock |
| P-868647820 | 98 | As is | in stock |
| P-861985701 | 95 | As is | 127 g |
| P-905337261 | 95 | As is | 127 g |
| P-579522934 | 90 | As is | 1 mg |
| P-890211749 | 90 | As is | 1 mg |
| P-505525619 | 95 | As is | in stock |
| P-492220241 | 95 | As is | in stock |
| P-454287807 | 90 | As is | unavailable |
| P-579622121 | 95 | As is | 250 g |
| P-863655598 | 95 | As is | by synthesis |
| P-580483478 | 97 | As is | by synthesis |
| P-852441835 | N/A | As is | in stock |
| P-904720907 | 90 | As is | in stock |
| P-854728057 | 95 | As is | in stock |
| P-492280301 | 95 | As is | 240 mg |
| P-34031088 | 90 | As is | 240 mg |
| P-859989018 | 95 | As is | by synthesis |
| P-873284329 | N/A | As is | in stock |
| P-896074742 | N/A | As is | 38.983 g |
| P-596747095 | 97 | As is | 782.5 g |
| P-33460150 | 90 | As is | in stock |
| P-502354680 | 90 | As is | in stock |
| P-906773436 | 98 | As is | by synthesis |
| P-611399798 | 90 | As is | in stock |
| P-615395611 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 227.054 |
| logP | 2.4143 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 0 |
| PSA | 26.3 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 48.7145 |
| Atoms | 19 |
| Rings | 2 |
| Heavy atoms | 12 |
| Hydrogen atoms | 7 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| 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 |

