Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9880876565
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 | 5 USD | 97 | 14 working days | Get Quote |
| 5 mg | 5 USD | 97 | 14 working days | Get Quote |
| 10 mg | 5 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-9880876565.sdf |
| SMILES | MCULE-9880876565.smiles |
| Standard InChI | MCULE-9880876565.inchi |
| InChIKey | MCULE-9880876565.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867576441 | 97 | As is | in stock |
| P-875736957 | 97 | As is | in stock |
| P-1275184395 | 95 | As is | in stock |
| P-1275189136 | 98 | As is | in stock |
| P-903066746 | 97 | As is | 300 g |
| P-905480978 | 98 | As is | 10 g |
| P-610992182 | 90 | As is | 1.976 kg |
| P-1270336922 | 97 | As is | in stock |
| P-580238125 | 95 | As is | by synthesis |
| P-617064810 | 98 | As is | in stock |
| P-606844799 | N/A | As is | in stock |
| P-489129490 | 97 | As is | in stock |
| P-596951404 | 97 | As is | 200 g |
| P-494307028 | 95 | As is | by resynthesis (? - ? days) |
| P-864094488 | 95 | As is | in stock |
| P-580732956 | 97 | As is | 111.25 g |
| P-893230416 | 95 | As is | in stock |
| P-851275707 | 95 | As is | by synthesis |
| P-861280752 | 97 | As is | in stock |
| P-868578257 | 98 | As is | in stock |
| P-580405255 | 95 | As is | by resynthesis (? - ? days) |
| P-861955856 | 97 | As is | 194 g |
| P-905331850 | 97 | As is | 46 g |
| P-505518852 | 95 | As is | in stock |
| P-454343635 | 90 | As is | 55 mg |
| P-579612231 | 98 | As is | in stock |
| P-580462456 | 95 | As is | by synthesis |
| P-1272583068 | 97 | As is | 25 g |
| P-852450935 | 97 | As is | by synthesis |
| P-35233284 | 90 | As is | in stock |
| P-863690754 | 95 | As is | in stock |
| P-500370637 | 98 | As is | by synthesis |
| P-885539108 | 95 | As is | by synthesis |
| P-596772188 | 97 | As is | 489.7 g |
| P-502370499 | 90 | As is | in stock |
| P-906770505 | 97 | As is | by synthesis |
| P-611435699 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 154.138 |
| logP | 1.8323 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 37.3 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 38.3253 |
| Atoms | 18 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 7 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
