Identifier: MM422133
2D Structure
3D Structure
Source:
General | |
Identifier | MM422133 |
SMILES |
C=CC(=CC)C(C)=CC#N
|
InChIKey |
UAZMTPGZMVXUDH-UHFFFAOYSA-N
|
MW [Da] |
133.19
Automatically obtained from RDkit software. |
LogP |
2.59
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM175612
Similarity: 0.8431
Similarity to MM175612
Tanimoto metric | 0.8431 |
---|---|
Cosine metric | 0.9182 |
Dice metric | 0.9149 |
MW: | 119.17 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 2.2 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM175724
Similarity: 0.6863
Similarity to MM175724
Tanimoto metric | 0.6863 |
---|---|
Cosine metric | 0.8284 |
Dice metric | 0.814 |
MW: | 121.18 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 2.42 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM297005
Similarity: 0.6731
Similarity to MM297005
Tanimoto metric | 0.6731 |
---|---|
Cosine metric | 0.8168 |
Dice metric | 0.8046 |
MW: | 132.17 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.93 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+155 more