Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM124709
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM124709 |
| SMILES |
CNCCC1NC1C
|
| InChIKey |
YUZXVJRLTLLRHA-UHFFFAOYSA-N
|
| MW [Da] |
114.19
Automatically obtained from RDkit software. |
| LogP |
-0.04
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM195349
Similarity: 0.9195
Similarity to MM195349
| Tanimoto metric | 0.9195 |
|---|---|
| Cosine metric | 0.9589 |
| Dice metric | 0.9581 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM216538
Similarity: 0.8421
Similarity to MM216538
| Tanimoto metric | 0.8421 |
|---|---|
| Cosine metric | 0.9177 |
| Dice metric | 0.9143 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM192988
Similarity: 0.8163
Similarity to MM192988
| Tanimoto metric | 0.8163 |
|---|---|
| Cosine metric | 0.9035 |
| Dice metric | 0.8989 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+238 more
