Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM437975
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM437975 |
| SMILES |
CCC=CCC(C)(O)CC
|
| InChIKey |
HLPAAQPFLFBUGY-UHFFFAOYSA-N
|
| MW [Da] |
142.24
Automatically obtained from RDkit software. |
| LogP |
2.5
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM437799
Similarity: 0.9048
Similarity to MM437799
| Tanimoto metric | 0.9048 |
|---|---|
| Cosine metric | 0.9512 |
| Dice metric | 0.95 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM452896
Similarity: 0.8444
Similarity to MM452896
| Tanimoto metric | 0.8444 |
|---|---|
| Cosine metric | 0.9157 |
| Dice metric | 0.9157 |
| MW: | 142.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM297033
Similarity: 0.8211
Similarity to MM297033
| Tanimoto metric | 0.8211 |
|---|---|
| Cosine metric | 0.9021 |
| Dice metric | 0.9017 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+580 more
