Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM447003
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM447003 |
| SMILES |
C=CCNCCNCCN
|
| InChIKey |
QQTDNXGRTOHWRH-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
-0.69
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM73710
Similarity: 0.9024
Similarity to MM73710
| Tanimoto metric | 0.9024 |
|---|---|
| Cosine metric | 0.95 |
| Dice metric | 0.9487 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM71790
Similarity: 0.8537
Similarity to MM71790
| Tanimoto metric | 0.8537 |
|---|---|
| Cosine metric | 0.9239 |
| Dice metric | 0.9211 |
| MW: | 114.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM447633
Similarity: 0.74
Similarity to MM447633
| Tanimoto metric | 0.74 |
|---|---|
| Cosine metric | 0.852 |
| Dice metric | 0.8506 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+391 more
