Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4591882669
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 | 7 USD | 97 | 22 working days | Get Quote |
| 5 mg | 18 USD | 95 | 19 working days | Get Quote |
| 10 mg | 36 USD | 95 | 19 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 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-3192862255
- Component type: Main
-
MCULE-8779277355
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4591882669.sdf |
| SMILES | MCULE-4591882669.smiles |
| Standard InChI | MCULE-4591882669.inchi |
| InChIKey | MCULE-4591882669.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867430638 | N/A | As is | by synthesis |
| P-904729960 | N/A | As is | in stock |
| P-905474117 | 95 | As is | in stock |
| P-904367514 | 98 | As is | 450 mg |
| P-1263264868 | 95 | As is | by synthesis |
| P-502580512 | 95 | As is | by synthesis |
| P-855983354 | 97 | As is | 50 mg |
| P-854698367 | 95 | As is | by synthesis |
| P-885559447 | 95 | As is | by synthesis |
| P-869161539 | 95 | As is | by synthesis |
| P-888656850 | 95 | As is | unavailable |
| P-893099461 | N/A | As a main component | by synthesis |
| P-867585800 | 97 | As a main component | in stock |
| P-901305447 | N/A | As a main component | in stock |
| P-875744368 | N/A | As a main component | in stock |
| P-590372287 | 95 | As a main component | in stock |
| P-903075697 | 98 | As a main component | 5 g |
| P-893395563 | 90 | As a main component | by synthesis |
| P-893511432 | 90 | As a main component | 81.797 g |
| P-881619276 | N/A | As a main component | by synthesis |
| P-606841931 | N/A | As a main component | in stock |
| P-489233170 | 97 | As a main component | in stock |
| P-596954239 | 98 | As a main component | 5 g |
| P-872727992 | 98 | As a main component | in stock |
| P-895925904 | 95 | As a main component | by resynthesis (? - ? days) |
| P-864171478 | 97 | As a main component | in stock |
| P-580698207 | 97 | As a main component | 1.35 g |
| P-890226892 | 97 | As a main component | by synthesis |
| P-871218560 | N/A | As a main component | by resynthesis (? - ? days) |
| P-893225461 | 95 | As a main component | in stock |
| P-887200533 | 95 | As a main component | by synthesis |
| P-893622258 | 97 | As a main component | in stock |
| P-596546930 | 95 | As a main component | 1.025 g |
| P-524185081 | 95 | As a main component | 1.025 g |
| P-615655932 | 95 | As a main component | in stock |
| P-31174240 | 90 | As a main component | 250 mg |
| P-852465762 | N/A | As a main component | in stock |
| P-35283622 | 90 | As a main component | 19.315 kg |
| P-869036565 | 95 | As a main component | by synthesis |
| P-902988933 | 95 | As a main component | by synthesis |
| P-854721701 | 95 | As a main component | in stock |
| P-474022646 | 95 | As a main component | in stock |
| P-619673126 | 98 | As a main component | in stock |
| P-26345765 | 90 | As a main component | 1.419 g |
| P-617682405 | 95 | As a main component | 1.419 g |
| P-594274424 | 95 | As a main component | by synthesis |
| P-892295944 | 95 | As a main component | unavailable |
| P-888656849 | 95 | As a main component | 150 mg |
| P-906899728 | 98 | As a main component | in stock |
| P-906843519 | 97 | As a main component | by synthesis |
| P-611424273 | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 251.714 |
| logP | 1.8623 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 80.0 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 80.3758 |
| Atoms | 31 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 14 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| 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 |
