Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM170952
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM170952 |
| SMILES |
CC#CC#CC(F)=CC
|
| InChIKey |
ZEKDIPNLNMBGAL-UHFFFAOYSA-N
|
| MW [Da] |
122.14
Automatically obtained from RDkit software. |
| LogP |
1.89
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM369714
Similarity: 0.9589
Similarity to MM369714
| Tanimoto metric | 0.9589 |
|---|---|
| Cosine metric | 0.9792 |
| Dice metric | 0.979 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM369684
Similarity: 0.9459
Similarity to MM369684
| Tanimoto metric | 0.9459 |
|---|---|
| Cosine metric | 0.9726 |
| Dice metric | 0.9722 |
| MW: | 140.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM369735
Similarity: 0.8974
Similarity to MM369735
| Tanimoto metric | 0.8974 |
|---|---|
| Cosine metric | 0.9473 |
| Dice metric | 0.9459 |
| MW: | 132.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+686 more
