Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM272889
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM272889 |
| SMILES |
CC#CC(CC)CC(C)=O
|
| InChIKey |
NHROJJIYFAQEIT-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
2.02
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM135908
Similarity: 0.7917
Similarity to MM135908
| Tanimoto metric | 0.7917 |
|---|---|
| Cosine metric | 0.8898 |
| Dice metric | 0.8837 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.62 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM150093
Similarity: 0.7708
Similarity to MM150093
| Tanimoto metric | 0.7708 |
|---|---|
| Cosine metric | 0.878 |
| Dice metric | 0.8706 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.62 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM237712
Similarity: 0.7037
Similarity to MM237712
| Tanimoto metric | 0.7037 |
|---|---|
| Cosine metric | 0.8269 |
| Dice metric | 0.8261 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+304 more
