Identifier: MM36226
2D Structure
3D Structure
Source:
General | |
Identifier | MM36226 |
SMILES |
CC(C=O)OCC=O
|
InChIKey |
NDYJQPGWGZLYIU-UHFFFAOYSA-N
|
MW [Da] |
116.12
Automatically obtained from RDkit software. |
LogP |
-0.21
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM42800
Similarity: 0.9362
Similarity to MM42800
Tanimoto metric | 0.9362 |
---|---|
Cosine metric | 0.9676 |
Dice metric | 0.967 |
MW: | 130.14 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.18 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM97956
Similarity: 0.8636
Similarity to MM97956
Tanimoto metric | 0.8636 |
---|---|
Cosine metric | 0.9293 |
Dice metric | 0.9268 |
MW: | 102.13 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.61 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM104213
Similarity: 0.8511
Similarity to MM104213
Tanimoto metric | 0.8511 |
---|---|
Cosine metric | 0.9196 |
Dice metric | 0.9195 |
MW: | 116.16 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+329 more