Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8740822011
Compound
Show structures
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 | 29 USD | 98 | 9 working days | Get Quote |
| 5 mg | 29 USD | 98 | 9 working days | Get Quote |
| 10 mg | 29 USD | 98 | 9 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-2871439387
- Component type: Main
-
MCULE-7822379994
- Component type: Main
-
MCULE-1832345463
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-8740822011.sdf |
| SMILES | MCULE-8740822011.smiles |
| Standard InChI | MCULE-8740822011.inchi |
| InChIKey | MCULE-8740822011.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867562979 | 98 | As is | in stock |
| P-875722631 | 98 | As is | in stock |
| P-597028426 | 95 | As is | unavailable |
| P-1275190532 | 98 | As is | in stock |
| P-1275146919 | 95 | As is | in stock |
| P-489152827 | 97 | As is | in stock |
| P-864102843 | 97 | As is | in stock |
| P-901461770 | 95 | As is | by synthesis |
| P-868591802 | 98 | As is | in stock |
| P-580405116 | 95 | As is | by resynthesis (? - ? days) |
| P-590337827 | 90 | As is | 900 mg |
| P-890215393 | 90 | As is | in stock |
| P-31173787 | 90 | As is | unavailable |
| P-856043681 | 90 | As is | unavailable |
| P-1272581516 | 94 | As is | 20 g |
| P-852444190 | 94 | As is | by synthesis |
| P-1263718250 | 90 | As is | 90 mg |
| P-500398020 | 95 | As is | by synthesis |
| P-859992991 | 95 | As is | by synthesis |
| P-424905209 | 90 | As is | in stock |
| P-498639290 | 95 | As is | by synthesis |
| P-502365593 | 90 | As is | in stock |
| P-611384419 | 90 | As is | in stock |
| P-855029118 | 90 | As is | in stock |
| P-1270251922 | 98 | As a main component | in stock |
| P-892865962 | 98 | As a main component | in stock |
| P-867502124 | 97 | As a main component | by synthesis |
| P-890160987 | 98 | As a main component | in stock |
| P-1268849636 | 98 | As a main component | in stock |
| P-901199892 | 95 | As a main component | by synthesis |
| P-903161158 | 95 | As a main component | 900 mg |
| P-1272058668 | 98 | As a main component | 50 g |
| P-596933229 | 95 | As a main component | 900 mg |
| P-1274814449 | 95 | As a main component | by resynthesis (? - ? days) |
| P-1274839075 | 95 | As a main component | by resynthesis (? - ? days) |
| P-1275481793 | 95 | As a main component | in stock |
| P-905473223 | 95 | As a main component | in stock |
| P-901416605 | 95 | As a main component | by synthesis |
| P-500143822 | 95 | As a main component | in stock |
| P-502443248 | 95 | As a main component | in stock |
| P-33225121 | 90 | As a main component | in stock |
| P-855062074 | 90 | As a main component | in stock |
| P-855060651 | 90 | As a main component | in stock |
| P-1271514281 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 143.185 |
| logP | 3.0032 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 26.02 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 48.3524 |
| Atoms | 20 |
| Rings | 2 |
| Heavy atoms | 11 |
| Hydrogen atoms | 9 |
| 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 |
