Identifier: MM136026
2D Structure
3D Structure
Source:
General | |
Identifier | MM136026 |
SMILES |
CC(=O)CC(C)=CCF
|
InChIKey |
DNWNAPVBRUTMAT-UHFFFAOYSA-N
|
MW [Da] |
130.16
Automatically obtained from RDkit software. |
LogP |
1.88
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM265797
Similarity: 0.8
Similarity to MM265797
Tanimoto metric | 0.8 |
---|---|
Cosine metric | 0.8944 |
Dice metric | 0.8889 |
MW: | 144.19 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 2.27 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM265799
Similarity: 0.785
Similarity to MM265799
Tanimoto metric | 0.785 |
---|---|
Cosine metric | 0.886 |
Dice metric | 0.8796 |
MW: | 148.15 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.83 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM270707
Similarity: 0.7778
Similarity to MM270707
Tanimoto metric | 0.7778 |
---|---|
Cosine metric | 0.8819 |
Dice metric | 0.875 |
MW: | 144.19 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 2.27 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+597 more