Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM374716
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM374716 |
| SMILES |
CC=CC=CNC(=O)CO
|
| InChIKey |
OIQSZEZKRCLOPN-UHFFFAOYSA-N
|
| MW [Da] |
141.17
Automatically obtained from RDkit software. |
| LogP |
0.18
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM168656
Similarity: 0.8791
Similarity to MM168656
| Tanimoto metric | 0.8791 |
|---|---|
| Cosine metric | 0.9376 |
| Dice metric | 0.9357 |
| MW: | 127.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM113634
Similarity: 0.7363
Similarity to MM113634
| Tanimoto metric | 0.7363 |
|---|---|
| Cosine metric | 0.8581 |
| Dice metric | 0.8481 |
| MW: | 115.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM70159
Similarity: 0.7273
Similarity to MM70159
| Tanimoto metric | 0.7273 |
|---|---|
| Cosine metric | 0.8429 |
| Dice metric | 0.8421 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+503 more
