Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM358507
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM358507 |
| SMILES |
C=CC#CC(O)COC=O
|
| InChIKey |
ZSTALINHQDIPCN-UHFFFAOYSA-N
|
| MW [Da] |
140.14
Automatically obtained from RDkit software. |
| LogP |
-0.29
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM46522
Similarity: 0.8144
Similarity to MM46522
| Tanimoto metric | 0.8144 |
|---|---|
| Cosine metric | 0.9025 |
| Dice metric | 0.8977 |
| MW: | 128.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM46890
Similarity: 0.8041
Similarity to MM46890
| Tanimoto metric | 0.8041 |
|---|---|
| Cosine metric | 0.8967 |
| Dice metric | 0.8914 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM358441
Similarity: 0.7547
Similarity to MM358441
| Tanimoto metric | 0.7547 |
|---|---|
| Cosine metric | 0.861 |
| Dice metric | 0.8602 |
| MW: | 144.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+440 more
