Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM232579
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM232579 |
| SMILES |
CC(C)(F)CCC#CC#N
|
| InChIKey |
APPVOYJAHPHSJB-UHFFFAOYSA-N
|
| MW [Da] |
139.17
Automatically obtained from RDkit software. |
| LogP |
2.04
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM131659
Similarity: 0.8125
Similarity to MM131659
| Tanimoto metric | 0.8125 |
|---|---|
| Cosine metric | 0.9014 |
| Dice metric | 0.8966 |
| MW: | 128.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM153435
Similarity: 0.7875
Similarity to MM153435
| Tanimoto metric | 0.7875 |
|---|---|
| Cosine metric | 0.8874 |
| Dice metric | 0.8811 |
| MW: | 125.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM232563
Similarity: 0.7738
Similarity to MM232563
| Tanimoto metric | 0.7738 |
|---|---|
| Cosine metric | 0.8749 |
| Dice metric | 0.8725 |
| MW: | 142.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.93 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+415 more
