Identifier: MM285299
2D Structure
3D Structure
Source:
General | |
Identifier | MM285299 |
SMILES |
C=CC=CC=C(C)CC=O
|
InChIKey |
BPSXJCSXBATDCO-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
MM159692
Similarity: 0.8889
Similarity to MM159692
Tanimoto metric | 0.8889 |
---|---|
Cosine metric | 0.9428 |
Dice metric | 0.9412 |
MW: | 124.18 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 2.1 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM285251
Similarity: 0.8533
Similarity to MM285251
Tanimoto metric | 0.8533 |
---|---|
Cosine metric | 0.9215 |
Dice metric | 0.9209 |
MW: | 138.21 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 2.49 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM253716
Similarity: 0.8533
Similarity to MM253716
Tanimoto metric | 0.8533 |
---|---|
Cosine metric | 0.9215 |
Dice metric | 0.9209 |
MW: | 138.21 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 2.49 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+449 more