Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM458315
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM458315 |
| SMILES |
C=CC=CC=CC#CCF
|
| InChIKey |
GMPDVJAKMGQRIP-UHFFFAOYSA-N
|
| MW [Da] |
136.17
Automatically obtained from RDkit software. |
| LogP |
2.26
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM215881
Similarity: 0.8929
Similarity to MM215881
| Tanimoto metric | 0.8929 |
|---|---|
| Cosine metric | 0.9449 |
| Dice metric | 0.9434 |
| MW: | 124.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM458388
Similarity: 0.8621
Similarity to MM458388
| Tanimoto metric | 0.8621 |
|---|---|
| Cosine metric | 0.9266 |
| Dice metric | 0.9259 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM126585
Similarity: 0.7857
Similarity to MM126585
| Tanimoto metric | 0.7857 |
|---|---|
| Cosine metric | 0.8864 |
| Dice metric | 0.88 |
| MW: | 110.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+687 more
