Identifier: MM85115
2D Structure
3D Structure
Source:
General | |
Identifier | MM85115 |
SMILES |
C#CC(F)C(=O)CCCO
|
InChIKey |
LPSPKNQSDOAOPB-UHFFFAOYSA-N
|
MW [Da] |
144.15
Automatically obtained from RDkit software. |
LogP |
0.3
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM173528
Similarity: 0.7899
Similarity to MM173528
Tanimoto metric | 0.7899 |
---|---|
Cosine metric | 0.8888 |
Dice metric | 0.8826 |
MW: | 128.15 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.33 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM351501
Similarity: 0.6963
Similarity to MM351501
Tanimoto metric | 0.6963 |
---|---|
Cosine metric | 0.8216 |
Dice metric | 0.821 |
MW: | 146.14 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.28 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM66392
Similarity: 0.6478
Similarity to MM66392
Tanimoto metric | 0.6478 |
---|---|
Cosine metric | 0.7896 |
Dice metric | 0.7863 |
MW: | 144.15 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 0.3 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+135 more