Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM251253
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM251253 |
| SMILES |
C=C(F)CNC(=N)CC#N
|
| InChIKey |
UZTCLQCKQILOPP-UHFFFAOYSA-N
|
| MW [Da] |
141.15
Automatically obtained from RDkit software. |
| LogP |
0.95
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM144943
Similarity: 0.7966
Similarity to MM144943
| Tanimoto metric | 0.7966 |
|---|---|
| Cosine metric | 0.8925 |
| Dice metric | 0.8868 |
| MW: | 130.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM251107
Similarity: 0.7121
Similarity to MM251107
| Tanimoto metric | 0.7121 |
|---|---|
| Cosine metric | 0.8327 |
| Dice metric | 0.8319 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM64001
Similarity: 0.7034
Similarity to MM64001
| Tanimoto metric | 0.7034 |
|---|---|
| Cosine metric | 0.8387 |
| Dice metric | 0.8259 |
| MW: | 123.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+141 more
