Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM420390
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM420390 |
| SMILES |
CC1NC1CC#CCCN
|
| InChIKey |
UPDKOCFOJGYIGQ-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
0.09
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM195621
Similarity: 0.8818
Similarity to MM195621
| Tanimoto metric | 0.8818 |
|---|---|
| Cosine metric | 0.9377 |
| Dice metric | 0.9372 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM420397
Similarity: 0.8596
Similarity to MM420397
| Tanimoto metric | 0.8596 |
|---|---|
| Cosine metric | 0.926 |
| Dice metric | 0.9245 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM447937
Similarity: 0.8033
Similarity to MM447937
| Tanimoto metric | 0.8033 |
|---|---|
| Cosine metric | 0.8946 |
| Dice metric | 0.8909 |
| MW: | 133.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+148 more
