MCULE-2318549673
- 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 | 71 USD | 95 | 15 working days | Get Quote |
| 5 mg | 71 USD | 95 | 15 working days | Get Quote |
| 10 mg | 71 USD | 95 | 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.
-
MCULE-1535614102
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2318549673.sdf |
| SMILES | MCULE-2318549673.smiles |
| Standard InChI | MCULE-2318549673.inchi |
| InChIKey | MCULE-2318549673.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867540286 | 98 | As is | in stock |
| P-890138812 | 98 | As is | in stock |
| P-904616918 | 95 | As is | by resynthesis (? - ? days) |
| P-893450954 | 90 | As is | 2.488 g |
| P-1264209550 | N/A | As is | in stock |
| P-1272615744 | 95 | As is | by synthesis |
| P-1264199468 | 95 | As is | 8.005 g |
| P-851329187 | 95 | As is | by synthesis |
| P-1274899826 | 95 | As is | by synthesis |
| P-905324470 | 95 | As is | 500 mg |
| P-502586222 | 95 | As is | by synthesis |
| P-13953595 | 92 | As is | 300 mg |
| P-891635385 | 95 | As is | 250 mg |
| P-1267083340 | 95 | As is | 2.26 g |
| P-467970336 | 95 | As is | 261 mg |
| P-601066715 | 90 | As is | 261 mg |
| P-1267010848 | 95 | As is | in stock |
| P-855251042 | 90 | As is | in stock |
| P-904596579 | 95 | As a main component | by resynthesis (? - ? days) |
| P-851618030 | N/A | As a main component | by synthesis |
| P-864250177 | 95 | As a main component | by synthesis |
| P-590958821 | 95 | As a main component | by synthesis |
| P-895679646 | 95 | As a main component | by synthesis |
| P-1271473518 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 186.253 |
| logP | 2.0937 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 19.03 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 62.5417 |
| Atoms | 28 |
| Rings | 3 |
| Heavy atoms | 14 |
| Hydrogen atoms | 14 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |

