Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5778457701-1
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 | 14 USD | 95 | 20 working days | Get Quote |
| 5 mg | 14 USD | 95 | 20 working days | Get Quote |
| 10 mg | 14 USD | 95 | 20 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-8096594321-1
- Component type: Main
-
MCULE-7943329541-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5778457701-1.sdf |
| SMILES | MCULE-5778457701-1.smiles |
| Standard InChI | MCULE-5778457701-1.inchi |
| InChIKey | MCULE-5778457701-1.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867604387 | 98 | As is | in stock |
| P-875761997 | 98 | As is | in stock |
| P-853432634 | 95 | As is | by resynthesis (? - ? days) |
| P-1264056650 | 99 | As is | in stock |
| P-893505346 | 90 | As is | 833 mg |
| P-1270293044 | 98 | As is | in stock |
| P-851789332 | N/A | As is | by synthesis |
| P-489219256 | 97 | As is | in stock |
| P-873292069 | 98 | As is | 100 mg |
| P-1273404553 | 95 | As is | by resynthesis (? - ? days) |
| P-889560398 | 95 | As is | in stock |
| P-881630306 | 98 | As is | in stock |
| P-1272277200 | 95 | As is | by synthesis |
| P-893626022 | 95 | As is | by synthesis |
| P-579477169 | 95 | As is | in stock |
| P-580361816 | 95 | As is | by resynthesis (? - ? days) |
| P-1273135429 | 98 | As is | 100 mg |
| P-900319993 | 95 | As is | by synthesis |
| P-873242019 | 97 | As is | 5 mg |
| P-854691011 | 95 | As is | in stock |
| P-856970103 | 95 | As is | by synthesis |
| P-892305071 | 95 | As is | in stock |
| P-1274335919 | 95 | As is | unavailable |
| P-869165607 | 95 | As is | 899 mg |
| P-888660362 | 95 | As is | 897 mg |
| P-1270125662 | 98 | As a main component | in stock |
| P-875724105 | 95 | As a main component | in stock |
| P-1268827908 | 98 | As a main component | in stock |
| P-615720060 | 95 | As a main component | by resynthesis (? - ? days) |
| P-1264056458 | 98 | As a main component | in stock |
| P-893566957 | 90 | As a main component | 37.806 g |
| P-1270293724 | 95 | As a main component | in stock |
| P-606855454 | N/A | As a main component | in stock |
| P-1263093123 | N/A | As a main component | by synthesis |
| P-597007379 | 95 | As a main component | 2 g |
| P-895101646 | 98 | As a main component | 20 mg |
| P-1273454030 | 95 | As a main component | by resynthesis (? - ? days) |
| P-1273292788 | 95 | As a main component | by resynthesis (? - ? days) |
| P-864140529 | 95 | As a main component | in stock |
| P-616204602 | 95 | As a main component | 1.6 g |
| P-907566020 | 98 | As a main component | by synthesis |
| P-616235507 | 90 | As a main component | 100 mg |
| P-617653145 | 90 | As a main component | in stock |
| P-881630262 | 98 | As a main component | in stock |
| P-584607407 | 95 | As a main component | in stock |
| P-617324293 | 90 | As a main component | in stock |
| P-887100919 | 97 | As a main component | in stock |
| P-1264367639 | 95 | As a main component | 2 g |
| P-889436756 | 95 | As a main component | 13.166 g |
| P-675219629 | 95 | As a main component | in stock |
| P-24485630 | 92 | As a main component | 124 mg |
| P-454318700 | 90 | As a main component | unavailable |
| P-31179699 | 90 | As a main component | 100 mg |
| P-1272583202 | 97 | As a main component | 5 g |
| P-852451439 | 97 | As a main component | by synthesis |
| P-854690834 | 95 | As a main component | in stock |
| P-1263697810 | 95 | As a main component | in stock |
| P-1263154457 | 95 | As a main component | by synthesis |
| P-619673466 | 98 | As a main component | in stock |
| P-888893985 | N/A | As a main component | in stock |
| P-889865819 | 95 | As a main component | by synthesis |
| P-675117798 | 90 | As a main component | in stock |
| P-1274328596 | 95 | As a main component | in stock |
| P-869177833 | 95 | As a main component | in stock |
| P-892296239 | 95 | As a main component | unavailable |
| P-1274335219 | 95 | As a main component | unavailable |
| P-594274861 | 95 | As a main component | 5.125 g |
| P-1274344400 | 95 | As a main component | 174 mg |
| P-1274355852 | 95 | As a main component | 16 mg |
| P-892338630 | 95 | As a main component | 5.125 g |
| P-502361399 | 90 | As a main component | in stock |
| P-873228411 | 90 | As a main component | in stock |
| P-888594856 | 94 | As a main component | by resynthesis (? - ? days) |
| P-611523852 | 90 | As a main component | in stock |
| P-611474450 | 90 | As a main component | in stock |
| P-611474024 | 90 | As a main component | in stock |
| P-617780224 | 90 | As a main component | 110 mg |
| P-1271641302 | 98 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 141.168 |
| logP | 0.2708 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 40.54 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 41.7578 |
| Atoms | 21 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 11 |
| 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 |
