Identifier: MM214995
2D Structure
3D Structure
Source:
General | |
Identifier | MM214995 |
SMILES |
O=CCCC=COC=O
|
InChIKey |
DIZUOTLJUNQHFF-UHFFFAOYSA-N
|
MW [Da] |
128.13
Automatically obtained from RDkit software. |
LogP |
0.65
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM126137
Similarity: 0.807
Similarity to MM126137
Tanimoto metric | 0.807 |
---|---|
Cosine metric | 0.8983 |
Dice metric | 0.8932 |
MW: | 114.14 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.13 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM126647
Similarity: 0.7895
Similarity to MM126647
Tanimoto metric | 0.7895 |
---|---|
Cosine metric | 0.8885 |
Dice metric | 0.8824 |
MW: | 114.14 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.47 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM372863
Similarity: 0.7703
Similarity to MM372863
Tanimoto metric | 0.7703 |
---|---|
Cosine metric | 0.8777 |
Dice metric | 0.8702 |
MW: | 142.15 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.9 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+457 more