Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM253996
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM253996 |
| SMILES |
CC(CCC=O)C(=O)O
|
| InChIKey |
HKHIDJPZKVXQFU-UHFFFAOYSA-N
|
| MW [Da] |
130.14
Automatically obtained from RDkit software. |
| LogP |
0.69
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM244126
Similarity: 0.881
Similarity to MM244126
| Tanimoto metric | 0.881 |
|---|---|
| Cosine metric | 0.9386 |
| Dice metric | 0.9367 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.93 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM108159
Similarity: 0.8378
Similarity to MM108159
| Tanimoto metric | 0.8378 |
|---|---|
| Cosine metric | 0.9153 |
| Dice metric | 0.9118 |
| MW: | 116.16 |
||||
|---|---|---|---|---|---|
| PI: | 5
Total passive interactions
|
| LogP: | 1.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM47847
Similarity: 0.8049
Similarity to MM47847
| Tanimoto metric | 0.8049 |
|---|---|
| Cosine metric | 0.8919 |
| Dice metric | 0.8919 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+380 more
