Identifier: MM406307
2D Structure
3D Structure
Source:
General | |
Identifier | MM406307 |
SMILES |
C=CC#CC=C(C=O)C=O
|
InChIKey |
QASXUAHCQSVWAP-UHFFFAOYSA-N
|
MW [Da] |
134.13
Automatically obtained from RDkit software. |
LogP |
0.5
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM202129
Similarity: 0.8986
Similarity to MM202129
Tanimoto metric | 0.8986 |
---|---|
Cosine metric | 0.9479 |
Dice metric | 0.9466 |
MW: | 122.12 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.33 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM171684
Similarity: 0.8841
Similarity to MM171684
Tanimoto metric | 0.8841 |
---|---|
Cosine metric | 0.9402 |
Dice metric | 0.9385 |
MW: | 120.15 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.32 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM372003
Similarity: 0.8592
Similarity to MM372003
Tanimoto metric | 0.8592 |
---|---|
Cosine metric | 0.9252 |
Dice metric | 0.9242 |
MW: | 134.18 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.71 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+145 more