Identifier: MM173387
2D Structure
3D Structure
Source:
General | |
Identifier | MM173387 |
SMILES |
C=CCC(=C)C(C)C=O
|
InChIKey |
OJMDMAHVHYYTMJ-UHFFFAOYSA-N
|
MW [Da] |
124.18
Automatically obtained from RDkit software. |
LogP |
1.95
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM353534
Similarity: 0.798
Similarity to MM353534
Tanimoto metric | 0.798 |
---|---|
Cosine metric | 0.8933 |
Dice metric | 0.8876 |
MW: | 142.17 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 2.25 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM410756
Similarity: 0.767
Similarity to MM410756
Tanimoto metric | 0.767 |
---|---|
Cosine metric | 0.8758 |
Dice metric | 0.8681 |
MW: | 136.19 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 2.12 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM242358
Similarity: 0.767
Similarity to MM242358
Tanimoto metric | 0.767 |
---|---|
Cosine metric | 0.8758 |
Dice metric | 0.8681 |
MW: | 138.21 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 2.34 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+447 more