Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM385975
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM385975 |
| SMILES |
NCCC(CN)CNC=O
|
| InChIKey |
AYERIPZOLSVUEZ-UHFFFAOYSA-N
|
| MW [Da] |
145.21
Automatically obtained from RDkit software. |
| LogP |
-1.34
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM198645
Similarity: 0.825
Similarity to MM198645
| Tanimoto metric | 0.825 |
|---|---|
| Cosine metric | 0.9083 |
| Dice metric | 0.9041 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM155746
Similarity: 0.775
Similarity to MM155746
| Tanimoto metric | 0.775 |
|---|---|
| Cosine metric | 0.8803 |
| Dice metric | 0.8732 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM93212
Similarity: 0.7674
Similarity to MM93212
| Tanimoto metric | 0.7674 |
|---|---|
| Cosine metric | 0.8696 |
| Dice metric | 0.8684 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+395 more
