Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM250552
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM250552 |
| SMILES |
CC(O)CCC(C)OC=O
|
| InChIKey |
BHNKXOGOQQYZSV-UHFFFAOYSA-N
|
| MW [Da] |
146.19
Automatically obtained from RDkit software. |
| LogP |
0.71
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM107220
Similarity: 0.6835
Similarity to MM107220
| Tanimoto metric | 0.6835 |
|---|---|
| Cosine metric | 0.8268 |
| Dice metric | 0.812 |
| MW: | 116.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM90751
Similarity: 0.6804
Similarity to MM90751
| Tanimoto metric | 0.6804 |
|---|---|
| Cosine metric | 0.8102 |
| Dice metric | 0.8098 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM261408
Similarity: 0.6132
Similarity to MM261408
| Tanimoto metric | 0.6132 |
|---|---|
| Cosine metric | 0.7624 |
| Dice metric | 0.7602 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+370 more
