Identifier: MM70337
2D Structure
3D Structure
Source:
General | |
Identifier | MM70337 |
SMILES |
C=CC(=O)OC=CCN
|
InChIKey |
DCNSRNFFDHYKQJ-UHFFFAOYSA-N
|
MW [Da] |
127.14
Automatically obtained from RDkit software. |
LogP |
0.19
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM280716
Similarity: 0.8387
Similarity to MM280716
Tanimoto metric | 0.8387 |
---|---|
Cosine metric | 0.9158 |
Dice metric | 0.9123 |
MW: | 142.16 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | -0.53 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM113741
Similarity: 0.7821
Similarity to MM113741
Tanimoto metric | 0.7821 |
---|---|
Cosine metric | 0.8843 |
Dice metric | 0.8777 |
MW: | 112.13 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.25 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM106082
Similarity: 0.7564
Similarity to MM106082
Tanimoto metric | 0.7564 |
---|---|
Cosine metric | 0.8697 |
Dice metric | 0.8613 |
MW: | 115.13 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.02 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+235 more