Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2695490410-0
Structure
Show compound
In order to add this molecule to a collection you have to create an account.
Sign up for free
- 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 | 97 | 14 working days | Get Quote |
| 5 mg | 7 USD | 97 | 14 working days | Get Quote |
| 10 mg | 7 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-2695490410-0.sdf |
| SMILES | MCULE-2695490410-0.smiles |
| Standard InChI | MCULE-2695490410-0.inchi |
| InChIKey | MCULE-2695490410-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867552042 | 99 | As is | in stock |
| P-875709986 | 99 | As is | in stock |
| P-1275183175 | 98 | As is | in stock |
| P-1275171662 | 99 | As is | in stock |
| P-903037024 | 97 | As is | 50 g |
| P-893503512 | 90 | As is | 252.75 g |
| P-1270302083 | 99 | As is | in stock |
| P-606873949 | N/A | As is | in stock |
| P-489113574 | 97 | As is | in stock |
| P-596926939 | 98 | As is | 90 g |
| P-494353455 | 95 | As is | 33.5 g |
| P-864126456 | 95 | As is | in stock |
| P-619603541 | 99 | As is | 5.25 g |
| P-901553993 | 95 | As is | by synthesis |
| P-868612821 | 95 | As is | in stock |
| P-580432111 | 95 | As is | by resynthesis (? - ? days) |
| P-862092427 | 99 | As is | 64.75 g |
| P-611621210 | 98 | As is | in stock |
| P-870660065 | 95 | As is | in stock |
| P-503008440 | 90 | As is | by synthesis |
| P-563496547 | 95 | As is | 5 g |
| P-588716839 | 95 | As is | 100 mg |
| P-31267031 | 90 | As is | unavailable |
| P-856042731 | 90 | As is | unavailable |
| P-611664592 | 97 | As is | by synthesis |
| P-1272601613 | N/A | As is | 10 g |
| P-852580399 | N/A | As is | by synthesis |
| P-1275010966 | 95 | As is | in stock |
| P-889871062 | 95 | As is | by synthesis |
| P-502367228 | 90 | As is | in stock |
| P-22478316 | 90 | As is | 200 mg |
| P-611527257 | 90 | As is | in stock |
| P-1271721115 | 99 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 206.323 |
| logP | 4.2952 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 7 |
| PSA | 20.23 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 67.08 |
| Atoms | 37 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 22 |
| Heteroatoms | 1 |
| N/O atoms | 1 |
| 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 |
