Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM320122
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM320122 |
| SMILES |
C#CC(C)(OC)C(F)C#N
|
| InChIKey |
KMTJWDGNQGSREN-UHFFFAOYSA-N
|
| MW [Da] |
141.15
Automatically obtained from RDkit software. |
| LogP |
0.89
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM41603
Similarity: 0.7072
Similarity to MM41603
| Tanimoto metric | 0.7072 |
|---|---|
| Cosine metric | 0.8409 |
| Dice metric | 0.8285 |
| MW: | 127.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM139927
Similarity: 0.6906
Similarity to MM139927
| Tanimoto metric | 0.6906 |
|---|---|
| Cosine metric | 0.831 |
| Dice metric | 0.817 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM197067
Similarity: 0.6851
Similarity to MM197067
| Tanimoto metric | 0.6851 |
|---|---|
| Cosine metric | 0.8277 |
| Dice metric | 0.8131 |
| MW: | 127.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+128 more
