Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM450450
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM450450 |
| SMILES |
C=CC=CCCC=CC=O
|
| InChIKey |
JXZQUEAFRZRXCE-UHFFFAOYSA-N
|
| MW [Da] |
136.19
Automatically obtained from RDkit software. |
| LogP |
2.26
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM214033
Similarity: 0.8333
Similarity to MM214033
| Tanimoto metric | 0.8333 |
|---|---|
| Cosine metric | 0.9129 |
| Dice metric | 0.9091 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM126196
Similarity: 0.7917
Similarity to MM126196
| Tanimoto metric | 0.7917 |
|---|---|
| Cosine metric | 0.8898 |
| Dice metric | 0.8837 |
| MW: | 110.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM457146
Similarity: 0.7241
Similarity to MM457146
| Tanimoto metric | 0.7241 |
|---|---|
| Cosine metric | 0.8407 |
| Dice metric | 0.84 |
| MW: | 136.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+625 more
