Identifier: MM173833
2D Structure
3D Structure
Source:
General | |
Identifier | MM173833 |
SMILES |
C=CC(=C)C(=C)CC=O
|
InChIKey |
MGXPCPQFLRGGQQ-UHFFFAOYSA-N
|
MW [Da] |
122.17
Automatically obtained from RDkit software. |
LogP |
1.87
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM299065
Similarity: 0.7755
Similarity to MM299065
Tanimoto metric | 0.7755 |
---|---|
Cosine metric | 0.8806 |
Dice metric | 0.8736 |
MW: | 136.19 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 2.26 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM34648
Similarity: 0.7632
Similarity to MM34648
Tanimoto metric | 0.7632 |
---|---|
Cosine metric | 0.8736 |
Dice metric | 0.8657 |
MW: | 110.16 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 1.71 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM295093
Similarity: 0.7525
Similarity to MM295093
Tanimoto metric | 0.7525 |
---|---|
Cosine metric | 0.8675 |
Dice metric | 0.8588 |
MW: | 136.19 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 2.26 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+248 more