Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM287682
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM287682 |
| SMILES |
N=C(N)CCCC=CC=O
|
| InChIKey |
RBIJDCNCLQKVIW-UHFFFAOYSA-N
|
| MW [Da] |
140.19
Automatically obtained from RDkit software. |
| LogP |
0.85
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM152957
Similarity: 0.8333
Similarity to MM152957
| Tanimoto metric | 0.8333 |
|---|---|
| Cosine metric | 0.9129 |
| Dice metric | 0.9091 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM287573
Similarity: 0.8125
Similarity to MM287573
| Tanimoto metric | 0.8125 |
|---|---|
| Cosine metric | 0.8991 |
| Dice metric | 0.8966 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM287681
Similarity: 0.7386
Similarity to MM287681
| Tanimoto metric | 0.7386 |
|---|---|
| Cosine metric | 0.8498 |
| Dice metric | 0.8497 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.83 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+514 more
