Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6474808307-0
Structure
Show compound
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 | 97 | 14 working days | Get Quote |
| 5 mg | 6 USD | 97 | 14 working days | Get Quote |
| 10 mg | 6 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.
-
MCULE-9540871772-0
- Component type: Main
-
MCULE-6472685108-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6474808307-0.sdf |
| SMILES | MCULE-6474808307-0.smiles |
| Standard InChI | MCULE-6474808307-0.inchi |
| InChIKey | MCULE-6474808307-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867586600 | 97 | As is | in stock |
| P-875745413 | 97 | As is | in stock |
| P-597016324 | 95 | As is | unavailable |
| P-1275192723 | N/A | As is | in stock |
| P-903076163 | 97 | As is | 500 g |
| P-893555305 | 90 | As is | 2.69828 kg |
| P-1270319221 | 98 | As is | in stock |
| P-580234256 | 95 | As is | by synthesis |
| P-851954483 | N/A | As is | in stock |
| P-489127192 | 97 | As is | in stock |
| P-596984193 | 97 | As is | 800 g |
| P-864088443 | 95 | As is | in stock |
| P-481171599 | 95 | As is | 27 g |
| P-619605731 | 97 | As is | 31 g |
| P-878239885 | 98 | As is | in stock |
| P-454639986 | 90 | As is | in stock |
| P-436469734 | 95 | As is | in stock |
| P-851271737 | 95 | As is | by synthesis |
| P-868582226 | 98 | As is | in stock |
| P-580428369 | 95 | As is | by resynthesis (? - ? days) |
| P-1264334674 | 97 | As is | 363 g |
| P-870647538 | N/A | As is | in stock |
| P-579515912 | 90 | As is | 20 g |
| P-890209735 | 90 | As is | in stock |
| P-454416420 | 95 | As is | 25 g |
| P-454350009 | 95 | As is | 100 mg |
| P-579619129 | 95 | As is | in stock |
| P-613277285 | 95 | As is | by synthesis |
| P-1272583480 | 95 | As is | 100 g |
| P-852452269 | 95 | As is | by synthesis |
| P-854737477 | 95 | As is | in stock |
| P-859985138 | 95 | As is | by synthesis |
| P-23343182 | 90 | As is | in stock |
| P-888227387 | 90 | As is | 7 mg |
| P-1271638434 | 98 | As is | in stock |
| P-1270258280 | 95 | As a main component | in stock |
| P-852154593 | N/A | As a main component | by synthesis |
| P-1274657659 | 98 | As a main component | in stock |
| P-890042423 | N/A | As a main component | by synthesis |
| P-874651228 | 95 | As a main component | by resynthesis (? - ? days) |
| P-891659920 | N/A | As a main component | by synthesis |
| P-1274632102 | 95 | As a main component | 150 g |
| P-865935065 | 95 | As a main component | 1000 mg |
| P-1275514993 | 95 | As a main component | by resynthesis (? - ? days) |
| P-1273378701 | 95 | As a main component | by resynthesis (? - ? days) |
| P-864194761 | 95 | As a main component | in stock |
| P-1275585568 | 97 | As a main component | by synthesis |
| P-901897618 | 95 | As a main component | by synthesis |
| P-1274904221 | 95 | As a main component | by synthesis |
| P-901648863 | 95 | As a main component | in stock |
| P-1275230943 | 95 | As a main component | 1000 mg |
| P-1275089838 | 95 | As a main component | 25 g |
| P-855991486 | 95 | As a main component | 1000 mg |
| P-1272510854 | 95 | As a main component | in stock |
| P-895701898 | 95 | As a main component | by synthesis |
| P-873218417 | 90 | As a main component | in stock |
| P-893980085 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 172.225 |
| logP | -0.2786 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 41.57 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 53.2687 |
| Atoms | 28 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 16 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
