Identifier: MM200888
2D Structure
3D Structure
Source:
General | |
Identifier | MM200888 |
SMILES |
CC=C(C=CCO)CC
|
InChIKey |
GPQGXUVSYSVWSN-UHFFFAOYSA-N
|
MW [Da] |
126.2
Automatically obtained from RDkit software. |
LogP |
1.89
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM114224
Similarity: 0.7465
Similarity to MM114224
Tanimoto metric | 0.7465 |
---|---|
Cosine metric | 0.864 |
Dice metric | 0.8548 |
MW: | 112.17 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.5 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM379166
Similarity: 0.7396
Similarity to MM379166
Tanimoto metric | 0.7396 |
---|---|
Cosine metric | 0.86 |
Dice metric | 0.8503 |
MW: | 140.18 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.07 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM379303
Similarity: 0.7245
Similarity to MM379303
Tanimoto metric | 0.7245 |
---|---|
Cosine metric | 0.8512 |
Dice metric | 0.8402 |
MW: | 136.19 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.5 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+853 more