Identifier: MM126614
2D Structure
3D Structure
Source:
General | |
Identifier | MM126614 |
SMILES |
COCC=CCCO
|
InChIKey |
NWCPRNWUZBCAFQ-UHFFFAOYSA-N
|
MW [Da] |
116.16
Automatically obtained from RDkit software. |
LogP |
0.57
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM100860
Similarity: 0.8049
Similarity to MM100860
Tanimoto metric | 0.8049 |
---|---|
Cosine metric | 0.8971 |
Dice metric | 0.8919 |
MW: | 100.16 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.6 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM214929
Similarity: 0.7885
Similarity to MM214929
Tanimoto metric | 0.7885 |
---|---|
Cosine metric | 0.888 |
Dice metric | 0.8817 |
MW: | 128.17 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.09 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM451591
Similarity: 0.7885
Similarity to MM451591
Tanimoto metric | 0.7885 |
---|---|
Cosine metric | 0.888 |
Dice metric | 0.8817 |
MW: | 142.2 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.13 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+892 more