Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM386072
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM386072 |
| SMILES |
C=CC(=CCC#N)CCC
|
| InChIKey |
LMLOEIRINLFDGV-UHFFFAOYSA-N
|
| MW [Da] |
135.21
Automatically obtained from RDkit software. |
| LogP |
2.81
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM201739
Similarity: 0.8313
Similarity to MM201739
| Tanimoto metric | 0.8313 |
|---|---|
| Cosine metric | 0.9118 |
| Dice metric | 0.9079 |
| MW: | 121.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM382161
Similarity: 0.7766
Similarity to MM382161
| Tanimoto metric | 0.7766 |
|---|---|
| Cosine metric | 0.8743 |
| Dice metric | 0.8743 |
| MW: | 135.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM386179
Similarity: 0.7
Similarity to MM386179
| Tanimoto metric | 0.7 |
|---|---|
| Cosine metric | 0.8238 |
| Dice metric | 0.8235 |
| MW: | 135.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+758 more
