Identifier: MM294693
2D Structure
3D Structure
Source:
General | |
Identifier | MM294693 |
SMILES |
CC#CC#CC(=O)C(C)O
|
InChIKey |
BSEJAXMUMLBEPL-UHFFFAOYSA-N
|
MW [Da] |
136.15
Automatically obtained from RDkit software. |
LogP |
-0.04
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM48369
Similarity: 0.8868
Similarity to MM48369
Tanimoto metric | 0.8868 |
---|---|
Cosine metric | 0.9417 |
Dice metric | 0.94 |
MW: | 122.12 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | -0.43 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM34787
Similarity: 0.7075
Similarity to MM34787
Tanimoto metric | 0.7075 |
---|---|
Cosine metric | 0.8412 |
Dice metric | 0.8287 |
MW: | 112.13 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | -0.04 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM358916
Similarity: 0.7015
Similarity to MM358916
Tanimoto metric | 0.7015 |
---|---|
Cosine metric | 0.8266 |
Dice metric | 0.8246 |
MW: | 136.15 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | -0.04 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+186 more