MCULE-9607764367
- 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 | 12 USD | 95 | 20 working days | Get Quote |
| 5 mg | 12 USD | 95 | 20 working days | Get Quote |
| 10 mg | 12 USD | 95 | 20 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-9607764367.sdf |
| SMILES | MCULE-9607764367.smiles |
| Standard InChI | MCULE-9607764367.inchi |
| InChIKey | MCULE-9607764367.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867635811 | 95 | As is | in stock |
| P-875801420 | N/A | As is | in stock |
| P-590391950 | 95 | As is | in stock |
| P-903155516 | 97 | As is | 75 g |
| P-610980337 | 90 | As is | 215.996 g |
| P-580242743 | 95 | As is | by synthesis |
| P-606833214 | N/A | As is | in stock |
| P-489170594 | 97 | As is | in stock |
| P-596967605 | 95 | As is | 50 g |
| P-589655231 | 95 | As is | by resynthesis (? - ? days) |
| P-864103409 | 95 | As is | in stock |
| P-580733978 | 95 | As is | 41.25 g |
| P-851248355 | 95 | As is | by synthesis |
| P-868651870 | 97 | As is | in stock |
| P-580430281 | 95 | As is | by resynthesis (? - ? days) |
| P-861980454 | 97 | As is | 7 g |
| P-454344162 | 95 | As is | 92 mg |
| P-454412588 | 95 | As is | 5 g |
| P-852440424 | N/A | As is | in stock |
| P-519753170 | 95 | As is | 7 g |
| P-428012797 | 95 | As is | 3.276 kg |
| P-901572709 | 95 | As is | in stock |
| P-888895235 | N/A | As is | in stock |
| P-889884795 | 95 | As is | by synthesis |
| P-596788287 | 95 | As is | 82.5 g |
| P-502360751 | 90 | As is | in stock |
| P-611371918 | 90 | As is | in stock |
| P-893939463 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 199.205 |
| logP | 2.4468 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 50.19 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 56.6323 |
| Atoms | 24 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 9 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |

