Identifier: MM213664
2D Structure
3D Structure
Source:
General | |
Identifier | MM213664 |
SMILES |
C=CC=CCCNCC
|
InChIKey |
UKUDNCGBOBHADR-UHFFFAOYSA-N
|
MW [Da] |
125.22
Automatically obtained from RDkit software. |
LogP |
1.73
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM448393
Similarity: 0.9273
Similarity to MM448393
Tanimoto metric | 0.9273 |
---|---|
Cosine metric | 0.963 |
Dice metric | 0.9623 |
MW: | 139.24 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 2.12 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM448840
Similarity: 0.8644
Similarity to MM448840
Tanimoto metric | 0.8644 |
---|---|
Cosine metric | 0.9297 |
Dice metric | 0.9273 |
MW: | 137.23 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.89 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM126066
Similarity: 0.8431
Similarity to MM126066
Tanimoto metric | 0.8431 |
---|---|
Cosine metric | 0.9182 |
Dice metric | 0.9149 |
MW: | 111.19 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.34 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+807 more