Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM233014
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM233014 |
| SMILES |
CCC#CC#CC(C)(C)F
|
| InChIKey |
MZUSVXMFGLKUOH-UHFFFAOYSA-N
|
| MW [Da] |
138.19
Automatically obtained from RDkit software. |
| LogP |
2.15
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM233017
Similarity: 0.942
Similarity to MM233017
| Tanimoto metric | 0.942 |
|---|---|
| Cosine metric | 0.9701 |
| Dice metric | 0.9701 |
| MW: | 142.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM131961
Similarity: 0.9403
Similarity to MM131961
| Tanimoto metric | 0.9403 |
|---|---|
| Cosine metric | 0.9697 |
| Dice metric | 0.9692 |
| MW: | 124.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM236140
Similarity: 0.8955
Similarity to MM236140
| Tanimoto metric | 0.8955 |
|---|---|
| Cosine metric | 0.9463 |
| Dice metric | 0.9449 |
| MW: | 138.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+513 more
