Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM352842
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM352842 |
| SMILES |
C=CC(N)C(O)CC=CF
|
| InChIKey |
KJGABIGCHOXALA-UHFFFAOYSA-N
|
| MW [Da] |
145.18
Automatically obtained from RDkit software. |
| LogP |
0.73
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM55974
Similarity: 0.8629
Similarity to MM55974
| Tanimoto metric | 0.8629 |
|---|---|
| Cosine metric | 0.9268 |
| Dice metric | 0.9264 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM162802
Similarity: 0.8036
Similarity to MM162802
| Tanimoto metric | 0.8036 |
|---|---|
| Cosine metric | 0.8964 |
| Dice metric | 0.8911 |
| MW: | 133.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM59444
Similarity: 0.7857
Similarity to MM59444
| Tanimoto metric | 0.7857 |
|---|---|
| Cosine metric | 0.8864 |
| Dice metric | 0.88 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+423 more
