Common name
ethanamine
IUPAC name
ethanamine
SMILES
CCN
Common name
ethanamine
IUPAC name
ethanamine
SMILES
CCN
INCHI
InChI=1S/C2H7N/c1-2-3/h2-3H2,1H3
FORMULA
C2H7N
Common name
ethanamine
IUPAC name
ethanamine
Molecular weight
45.084
clogP
-0.554
clogS
-0.083
Frequency
0.0677
HBond Acceptor
0
HBond Donor
2
Total PolarSurface Area
26.02
Number of Rings
0
Rotatable Bond
0
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD02886 | rhodethanil |
|
Herbicide | Herbicide |
| FDBD02893 | butylamine |
|
Fungicide | Fungicide |
| FDBD02895 | dodicin |
|
Fungicide | Fungicide |
| FDBD02896 | dodine |
|
Fungicide | Fungicide |
| FDBD02968 | blasticidin-S |
|
Fungicide | Fungicide |
| FDBD03173 | izopamfos |
|
Fungicide | Fungicide |
| FDBD03266 | spiroxamine |
|
Fungicide | Fungicide |
197 ,
20
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 2viv_ligand_1_5.mol2 | 2viv | 1 | -5.79 | CC[NH3+] | 3 |
| 1lah_ligand_1_2.mol2 | 1lah | 1 | -5.78 | CC[NH3+] | 3 |
| 1pot_ligand_1_0.mol2 | 1pot | 1 | -5.78 | [NH3+]CC | 3 |
| 2vio_ligand_1_0.mol2 | 2vio | 1 | -5.78 | [NH3+]CC | 3 |
| 1jq3_ligand_1_0.mol2 | 1jq3 | 1 | -5.77 | CC[NH3+] | 3 |
| 3e9h_ligand_1_3.mol2 | 3e9h | 1 | -5.77 | CC[NH3+] | 3 |
| 1ekb_ligand_1_13.mol2 | 1ekb | 1 | -5.76 | C([NH3+])C | 3 |
| 1tnj_ligand_1_1.mol2 | 1tnj | 1 | -5.76 | C([NH3+])C | 3 |
| 2pt9_ligand_1_0.mol2 | 2pt9 | 1 | -5.76 | CC[NH3+] | 3 |
| 2r59_ligand_1_1.mol2 | 2r59 | 1 | -5.76 | C([NH3+])C | 3 |
1149 ,
115
