Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM268601
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM268601 |
| SMILES |
CC(=O)OC(C)C(C)C=O
|
| InChIKey |
MGZYGQQVQZBHIQ-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
0.77
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM172195
Similarity: 0.7217
Similarity to MM172195
| Tanimoto metric | 0.7217 |
|---|---|
| Cosine metric | 0.8496 |
| Dice metric | 0.8384 |
| MW: | 130.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM245001
Similarity: 0.6412
Similarity to MM245001
| Tanimoto metric | 0.6412 |
|---|---|
| Cosine metric | 0.7833 |
| Dice metric | 0.7814 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.98 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM262091
Similarity: 0.6336
Similarity to MM262091
| Tanimoto metric | 0.6336 |
|---|---|
| Cosine metric | 0.7779 |
| Dice metric | 0.7757 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+114 more
