Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5966147414-0
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 | 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-4619135468-0
- Component type: Unknown
| Name | File |
|---|---|
| SDF | MCULE-5966147414-0.sdf |
| SMILES | MCULE-5966147414-0.smiles |
| Standard InChI | MCULE-5966147414-0.inchi |
| InChIKey | MCULE-5966147414-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867582055 | 97 | As is | in stock |
| P-875740874 | 98 | As is | in stock |
| P-1275143119 | 95 | As is | in stock |
| P-1275181014 | 99 | As is | in stock |
| P-1275179239 | 98 | As is | in stock |
| P-903070999 | 98 | As is | 2 kg |
| P-907307072 | 95 | As is | 101 g |
| P-901167518 | 98 | As is | in stock |
| P-1270349516 | 98 | As is | in stock |
| P-580199664 | 95 | As is | 6 g |
| P-617049430 | 98 | As is | by resynthesis (? - ? days) |
| P-606861355 | N/A | As is | in stock |
| P-489192248 | 97 | As is | in stock |
| P-596931310 | 97 | As is | 2 kg |
| P-494320600 | 95 | As is | 690 g |
| P-864096113 | 98 | As is | in stock |
| P-481165760 | 95 | As is | 490 g |
| P-580735099 | 98 | As is | 3.27 kg |
| P-505575964 | 98 | As is | in stock |
| P-454644731 | 90 | As is | in stock |
| P-851257734 | 95 | As is | by synthesis |
| P-868555145 | 98 | As is | in stock |
| P-580422099 | 95 | As is | by resynthesis (? - ? days) |
| P-901365776 | 97 | As is | 28.9 g |
| P-905328322 | 97 | As is | 1.01 kg |
| P-861921000 | 97 | As is | 20.6376 kg |
| P-505519118 | 95 | As is | in stock |
| P-454298182 | 90 | As is | 100 mg |
| P-579613220 | 98 | As is | in stock |
| P-31257421 | 90 | As is | unavailable |
| P-580514706 | 98 | As is | in stock |
| P-1272561025 | 98 | As is | 5 g |
| P-852376361 | 98 | As is | by synthesis |
| P-428002268 | 90 | As is | in stock |
| P-904721181 | 90 | As is | in stock |
| P-854727502 | 95 | As is | in stock |
| P-500371500 | 98 | As is | by synthesis |
| P-885548335 | 95 | As is | by synthesis |
| P-12272710 | 90 | As is | 5.796 g |
| P-596744798 | 98 | As is | 26.263 kg |
| P-502359779 | 90 | As is | in stock |
| P-906776773 | 98 | As is | by synthesis |
| P-611370776 | 90 | As is | in stock |
| P-1271606514 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 190.013 |
| logP | 2.7516 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 26.02 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 38.5044 |
| Atoms | 14 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 5 |
| 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 |
