Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1584714103-0
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 | 6 USD | 97 | 14 working days | Get Quote |
| 5 mg | 6 USD | 97 | 14 working days | Get Quote |
| 10 mg | 6 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-1584714103-0.sdf |
| SMILES | MCULE-1584714103-0.smiles |
| Standard InChI | MCULE-1584714103-0.inchi |
| InChIKey | MCULE-1584714103-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867553483 | 95 | As is | in stock |
| P-875711935 | 95 | As is | in stock |
| P-1275153130 | 95 | As is | in stock |
| P-1275174128 | 98 | As is | in stock |
| P-903038541 | 97 | As is | 2 kg |
| P-905476952 | 98 | As is | 100 g |
| P-1270276230 | 97 | As is | in stock |
| P-580237933 | 95 | As is | by synthesis |
| P-606936975 | N/A | As is | in stock |
| P-596927063 | 99 | As is | 25 kg |
| P-494345362 | 95 | As is | 3.9135 kg |
| P-1273455980 | 95 | As is | by resynthesis (? - ? days) |
| P-864113844 | 95 | As is | in stock |
| P-481168851 | 95 | As is | 31 g |
| P-580727829 | 97 | As is | 740 g |
| P-893233480 | 95 | As is | in stock |
| P-851272311 | 95 | As is | by synthesis |
| P-868576941 | 98 | As is | in stock |
| P-608495310 | 95 | As is | in stock |
| P-580279771 | 95 | As is | by resynthesis (? - ? days) |
| P-905428293 | 95 | As is | 2.17783 kg |
| P-905358944 | 95 | As is | 305 g |
| P-870655308 | N/A | As is | in stock |
| P-579489046 | 90 | As is | 16 g |
| P-890206190 | 90 | As is | in stock |
| P-505515724 | 95 | As is | in stock |
| P-502472873 | 95 | As is | by synthesis |
| P-454407723 | 97 | As is | 927 mg |
| P-454331341 | 97 | As is | 927 mg |
| P-601052270 | 90 | As is | 223 mg |
| P-580460824 | N/A | As is | by synthesis |
| P-1272575018 | 98 | As is | 1000 g |
| P-852425712 | 98 | As is | by synthesis |
| P-428009072 | 95 | As is | in stock |
| P-904721614 | 90 | As is | in stock |
| P-854692951 | 95 | As is | in stock |
| P-904059825 | 95 | As is | by synthesis |
| P-878643243 | 98 | As is | in stock |
| P-617703150 | 90 | As is | 600 mg |
| P-424331890 | 90 | As is | 600 mg |
| P-500380481 | 98 | As is | by synthesis |
| P-885533187 | 95 | As is | by synthesis |
| P-424839434 | 90 | As is | in stock |
| P-617403402 | 98 | As is | in stock |
| P-896080763 | N/A | As is | 226 mg |
| P-596785327 | 95 | As is | 1.464 kg |
| P-869175287 | 95 | As is | in stock |
| P-892286091 | 95 | As is | unavailable |
| P-892213245 | 95 | As is | 202 mg |
| P-892309660 | 95 | As is | 202 mg |
| P-33803090 | 90 | As is | in stock |
| P-502354504 | 90 | As is | in stock |
| P-903663515 | 94 | As is | by resynthesis (? - ? days) |
| P-906761971 | 98 | As is | by synthesis |
| P-611486260 | 90 | As is | in stock |
| P-580449701 | 97 | As is | in stock |
| P-3005606 | 90 | As is | 239 mg |
| P-1271633304 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 166.173 |
| logP | 1.3223 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 46.53 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 44.4788 |
| Atoms | 22 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 10 |
| 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 |
