Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM388006
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM388006 |
| SMILES |
C=CCC(CF)NC=NC
|
| InChIKey |
QOQRVLADSCQMMU-UHFFFAOYSA-N
|
| MW [Da] |
144.19
Automatically obtained from RDkit software. |
| LogP |
1.15
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM156775
Similarity: 0.6822
Similarity to MM156775
| Tanimoto metric | 0.6822 |
|---|---|
| Cosine metric | 0.826 |
| Dice metric | 0.8111 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM405726
Similarity: 0.6807
Similarity to MM405726
| Tanimoto metric | 0.6807 |
|---|---|
| Cosine metric | 0.812 |
| Dice metric | 0.81 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM387903
Similarity: 0.6378
Similarity to MM387903
| Tanimoto metric | 0.6378 |
|---|---|
| Cosine metric | 0.7792 |
| Dice metric | 0.7788 |
| MW: | 150.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.93 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+179 more
