Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM261084
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM261084 |
| SMILES |
C=CC(F)=CC#CC(=N)N
|
| InChIKey |
MQSQCDBDGFZXLA-UHFFFAOYSA-N
|
| MW [Da] |
138.15
Automatically obtained from RDkit software. |
| LogP |
0.97
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM133440
Similarity: 0.8019
Similarity to MM133440
| Tanimoto metric | 0.8019 |
|---|---|
| Cosine metric | 0.8955 |
| Dice metric | 0.8901 |
| MW: | 126.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM171674
Similarity: 0.717
Similarity to MM171674
| Tanimoto metric | 0.717 |
|---|---|
| Cosine metric | 0.8467 |
| Dice metric | 0.8352 |
| MW: | 125.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM261093
Similarity: 0.6967
Similarity to MM261093
| Tanimoto metric | 0.6967 |
|---|---|
| Cosine metric | 0.8215 |
| Dice metric | 0.8213 |
| MW: | 136.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+235 more
