Identifier: MM165891
2D Structure
3D Structure
Source:
General | |
Identifier | MM165891 |
SMILES |
C#CCOCC(O)CC
|
InChIKey |
JINFXKPVMSDNDW-UHFFFAOYSA-N
|
MW [Da] |
128.17
Automatically obtained from RDkit software. |
LogP |
0.41
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM291356
Similarity: 0.8481
Similarity to MM291356
Tanimoto metric | 0.8481 |
---|---|
Cosine metric | 0.9209 |
Dice metric | 0.9178 |
MW: | 144.17 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | -0.62 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM367275
Similarity: 0.8481
Similarity to MM367275
Tanimoto metric | 0.8481 |
---|---|
Cosine metric | 0.9209 |
Dice metric | 0.9178 |
MW: | 142.2 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.8 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM69416
Similarity: 0.8072
Similarity to MM69416
Tanimoto metric | 0.8072 |
---|---|
Cosine metric | 0.8985 |
Dice metric | 0.8933 |
MW: | 138.17 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 0.02 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+719 more