Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1711218804
Compound
Show structure
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 | 98 | 22 working days | Get Quote |
| 5 mg | 6 USD | 98 | 22 working days | Get Quote |
| 10 mg | 6 USD | 98 | 22 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-1711218804.sdf |
| SMILES | MCULE-1711218804.smiles |
| Standard InChI | MCULE-1711218804.inchi |
| InChIKey | MCULE-1711218804.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867563150 | 98 | As is | in stock |
| P-875722709 | 98 | As is | in stock |
| P-1275179837 | 98 | As is | in stock |
| P-1275151279 | 95 | As is | in stock |
| P-903051901 | 98 | As is | 3 kg |
| P-905480677 | 98 | As is | 10 g |
| P-1270321680 | 98 | As is | in stock |
| P-580199578 | 95 | As is | 8 g |
| P-617067927 | 99 | As is | in stock |
| P-606904550 | N/A | As is | in stock |
| P-489118318 | 97 | As is | in stock |
| P-596945916 | 97 | As is | 10 kg |
| P-1273457002 | 95 | As is | by resynthesis (? - ? days) |
| P-589653703 | 95 | As is | 191.8 g |
| P-864094677 | 95 | As is | in stock |
| P-580727460 | 98 | As is | 1.29 kg |
| P-893230947 | 95 | As is | in stock |
| P-619931183 | 90 | As is | by synthesis |
| P-5845075 | 90 | As is | 906 mg |
| P-578050018 | 98 | As is | in stock |
| P-425449253 | 90 | As is | in stock |
| P-851269679 | 95 | As is | by synthesis |
| P-861281059 | 97 | As is | in stock |
| P-868577527 | 98 | As is | in stock |
| P-579477482 | 95 | As is | in stock |
| P-580416328 | 95 | As is | by resynthesis (? - ? days) |
| P-861951854 | 98 | As is | 46.4811 kg |
| P-905331431 | 98 | As is | 730 g |
| P-608219077 | 98 | As is | in stock |
| P-590342075 | 90 | As is | 28.44 g |
| P-505491265 | 95 | As is | in stock |
| P-502547632 | 95 | As is | by synthesis |
| P-492234220 | 95 | As is | in stock |
| P-856009804 | 95 | As is | 363 mg |
| P-856089156 | 95 | As is | by resynthesis (? - ? days) |
| P-31256611 | 90 | As is | 500 mg |
| P-1268132424 | 90 | As is | 195 mg |
| P-580505051 | N/A | As is | by synthesis |
| P-852441517 | N/A | As is | by synthesis |
| P-1272579447 | N/A | As is | in stock |
| P-904721594 | 90 | As is | in stock |
| P-854691214 | 95 | As is | in stock |
| P-608280113 | 98 | As is | in stock |
| P-579714337 | N/A | As is | in stock |
| P-500403549 | 98 | As is | by synthesis |
| P-859995598 | 95 | As is | by synthesis |
| P-19784359 | 90 | As is | in stock |
| P-617402633 | 98 | As is | in stock |
| P-869176366 | 95 | As is | in stock |
| P-892292913 | 95 | As is | unavailable |
| P-580050181 | 95 | As is | 201 mg |
| P-892328400 | 95 | As is | 201 mg |
| P-502370579 | 90 | As is | in stock |
| P-23348019 | 94 | As is | by resynthesis (? - ? days) |
| P-855009718 | 90 | As is | in stock |
| P-25532938 | 90 | As is | 307 mg |
| P-1279093427 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 152.147 |
| logP | 1.2133 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 46.53 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 40.3445 |
| Atoms | 19 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 8 |
| 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 |
