Identifier: MM159584
2D Structure
3D Structure
Source:
General | |
Identifier | MM159584 |
SMILES |
C=CCC=C(C)CC=C
|
InChIKey |
ZBLAELKSGUNFIZ-UHFFFAOYSA-N
|
MW [Da] |
122.21
Automatically obtained from RDkit software. |
LogP |
3.08
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM107865
Similarity: 0.9362
Similarity to MM107865
Tanimoto metric | 0.9362 |
---|---|
Cosine metric | 0.9676 |
Dice metric | 0.967 |
MW: | 110.2 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 2.92 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM284939
Similarity: 0.8868
Similarity to MM284939
Tanimoto metric | 0.8868 |
---|---|
Cosine metric | 0.9417 |
Dice metric | 0.94 |
MW: | 136.24 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 3.48 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM114703
Similarity: 0.8298
Similarity to MM114703
Tanimoto metric | 0.8298 |
---|---|
Cosine metric | 0.9109 |
Dice metric | 0.907 |
MW: | 110.2 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 2.92 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+548 more