Identifier: MM292736
2D Structure
3D Structure
Source:
General | |
Identifier | MM292736 |
SMILES |
CC(CC#N)C(C)OC=O
|
InChIKey |
KFIWJIVSOPSYRS-UHFFFAOYSA-N
|
MW [Da] |
141.17
Automatically obtained from RDkit software. |
LogP |
1.1
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM171981
Similarity: 0.7315
Similarity to MM171981
Tanimoto metric | 0.7315 |
---|---|
Cosine metric | 0.8553 |
Dice metric | 0.8449 |
MW: | 130.19 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.59 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM296702
Similarity: 0.6124
Similarity to MM296702
Tanimoto metric | 0.6124 |
---|---|
Cosine metric | 0.7602 |
Dice metric | 0.7596 |
MW: | 144.21 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.84 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM296707
Similarity: 0.5899
Similarity to MM296707
Tanimoto metric | 0.5899 |
---|---|
Cosine metric | 0.7423 |
Dice metric | 0.7421 |
MW: | 146.19 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.56 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+170 more