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DocumentationIdentifier: MM303396
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM303396 |
| SMILES |
NCCN(CCF)CCF
|
| InChIKey |
CDBTXULBYNPUDM-UHFFFAOYSA-N
|
| MW [Da] |
152.19
Automatically obtained from RDkit software. |
| LogP |
0.19
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM177796
Similarity: 0.9286
Similarity to MM177796
| Tanimoto metric | 0.9286 |
|---|---|
| Cosine metric | 0.9636 |
| Dice metric | 0.963 |
| MW: | 134.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM271987
Similarity: 0.7324
Similarity to MM271987
| Tanimoto metric | 0.7324 |
|---|---|
| Cosine metric | 0.8489 |
| Dice metric | 0.8455 |
| MW: | 152.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM79680
Similarity: 0.697
Similarity to MM79680
| Tanimoto metric | 0.697 |
|---|---|
| Cosine metric | 0.8214 |
| Dice metric | 0.8214 |
| MW: | 134.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+233 more
