Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5048890497
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 | 98 | 14 working days | Get Quote |
| 5 mg | 5 USD | 98 | 14 working days | Get Quote |
| 10 mg | 5 USD | 98 | 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.
-
MCULE-4446575365
- Component type: Unknown
| Name | File |
|---|---|
| SDF | MCULE-5048890497.sdf |
| SMILES | MCULE-5048890497.smiles |
| Standard InChI | MCULE-5048890497.inchi |
| InChIKey | MCULE-5048890497.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867562894 | 98 | As is | in stock |
| P-875722437 | 98 | As is | in stock |
| P-597016200 | 98 | As is | unavailable |
| P-1275153352 | 95 | As is | in stock |
| P-1275175674 | 98 | As is | in stock |
| P-903051766 | 98 | As is | 3 kg |
| P-905478106 | 97 | As is | 100 g |
| P-1270311232 | 98 | As is | in stock |
| P-580238356 | 95 | As is | by synthesis |
| P-617066657 | 95 | As is | in stock |
| P-606917041 | N/A | As is | in stock |
| P-489174510 | 97 | As is | in stock |
| P-596945848 | 98 | As is | 4 kg |
| P-494349079 | 95 | As is | 76.4 g |
| P-864091502 | 97 | As is | in stock |
| P-580734612 | 98 | As is | 1.245 kg |
| P-871215213 | 95 | As is | by synthesis |
| P-861270901 | 95 | As is | in stock |
| P-868582961 | 98 | As is | in stock |
| P-580424795 | 95 | As is | by resynthesis (? - ? days) |
| P-861968690 | 98 | As is | 8.46366 kg |
| P-905333693 | 98 | As is | 1.72 kg |
| P-870658538 | N/A | As is | in stock |
| P-505527055 | 95 | As is | in stock |
| P-492221847 | 95 | As is | in stock |
| P-454407248 | 95 | As is | 199 mg |
| P-454329577 | 95 | As is | 199 mg |
| P-579612816 | 95 | As is | in stock |
| P-613284064 | 95 | As is | by synthesis |
| P-580515377 | 97 | As is | in stock |
| P-1272564924 | 98 | As is | 400 g |
| P-852383114 | 98 | As is | by synthesis |
| P-492286046 | 95 | As is | 740 mg |
| P-12962230 | 90 | As is | 740 mg |
| P-888858879 | N/A | As is | in stock |
| P-500400881 | 98 | As is | by synthesis |
| P-889885253 | 95 | As is | by synthesis |
| P-896078326 | N/A | As is | 3.056 g |
| P-498672146 | 97 | As is | 8.8053 kg |
| P-33803043 | 90 | As is | in stock |
| P-502329032 | 90 | As is | in stock |
| P-906773934 | 98 | As is | by synthesis |
| P-575299798 | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 192.439 |
| logP | 2.4975 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 0 |
| PSA | 12.89 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 36.947 |
| Atoms | 11 |
| Rings | 1 |
| Heavy atoms | 8 |
| Hydrogen atoms | 3 |
| Heteroatoms | 3 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
