Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM384055
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM384055 |
| SMILES |
CCC=C(C#N)C=CC#N
|
| InChIKey |
BMJGEZPMLRPVIF-UHFFFAOYSA-N
|
| MW [Da] |
132.17
Automatically obtained from RDkit software. |
| LogP |
1.93
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM201084
Similarity: 0.8235
Similarity to MM201084
| Tanimoto metric | 0.8235 |
|---|---|
| Cosine metric | 0.9075 |
| Dice metric | 0.9032 |
| MW: | 118.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM387372
Similarity: 0.7245
Similarity to MM387372
| Tanimoto metric | 0.7245 |
|---|---|
| Cosine metric | 0.8403 |
| Dice metric | 0.8402 |
| MW: | 133.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM336580
Similarity: 0.7228
Similarity to MM336580
| Tanimoto metric | 0.7228 |
|---|---|
| Cosine metric | 0.8393 |
| Dice metric | 0.8391 |
| MW: | 132.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.93 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+260 more
