Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM53117
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM53117 |
| SMILES |
C=CC(C=C)(C=C)CC
|
| InChIKey |
XOQVFKKWWWDYGE-UHFFFAOYSA-N
|
| MW [Da] |
122.21
Automatically obtained from RDkit software. |
| LogP |
2.94
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM35176
Similarity: 0.9091
Similarity to MM35176
| Tanimoto metric | 0.9091 |
|---|---|
| Cosine metric | 0.9535 |
| Dice metric | 0.9524 |
| MW: | 110.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 2.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM313044
Similarity: 0.7857
Similarity to MM313044
| Tanimoto metric | 0.7857 |
|---|---|
| Cosine metric | 0.8864 |
| Dice metric | 0.88 |
| MW: | 134.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM53072
Similarity: 0.7407
Similarity to MM53072
| Tanimoto metric | 0.7407 |
|---|---|
| Cosine metric | 0.8528 |
| Dice metric | 0.8511 |
| MW: | 124.23 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 3.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+297 more
