Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM384178
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM384178 |
| SMILES |
C#CC=CC(C#N)=CC=C
|
| InChIKey |
RHAIDFBSURCAFC-UHFFFAOYSA-N
|
| MW [Da] |
129.16
Automatically obtained from RDkit software. |
| LogP |
1.81
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM201113
Similarity: 0.8144
Similarity to MM201113
| Tanimoto metric | 0.8144 |
|---|---|
| Cosine metric | 0.9025 |
| Dice metric | 0.8977 |
| MW: | 117.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM384218
Similarity: 0.7248
Similarity to MM384218
| Tanimoto metric | 0.7248 |
|---|---|
| Cosine metric | 0.8409 |
| Dice metric | 0.8404 |
| MW: | 127.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM405795
Similarity: 0.7103
Similarity to MM405795
| Tanimoto metric | 0.7103 |
|---|---|
| Cosine metric | 0.8321 |
| Dice metric | 0.8306 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+79 more
