Identifier: MM237561
2D Structure
3D Structure
Source:
General | |
Identifier | MM237561 |
SMILES |
CCC=CC(=O)OC(C)C
|
InChIKey |
OKSNIKMUZNYBPP-UHFFFAOYSA-N
|
MW [Da] |
142.2
Automatically obtained from RDkit software. |
LogP |
1.9
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM135841
Similarity: 0.8316
Similarity to MM135841
Tanimoto metric | 0.8316 |
---|---|
Cosine metric | 0.9119 |
Dice metric | 0.908 |
MW: | 128.17 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.51 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM357784
Similarity: 0.7596
Similarity to MM357784
Tanimoto metric | 0.7596 |
---|---|
Cosine metric | 0.864 |
Dice metric | 0.8634 |
MW: | 140.18 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.68 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM281777
Similarity: 0.7453
Similarity to MM281777
Tanimoto metric | 0.7453 |
---|---|
Cosine metric | 0.8544 |
Dice metric | 0.8541 |
MW: | 142.2 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.91 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+533 more