
Common name
N'-ethylformamidine
IUPAC name
N'-ethylformamidine
SMILES
NC=NCC
Common name
N'-ethylformamidine
IUPAC name
N'-ethylformamidine
SMILES
NC=NCC
INCHI
InChI=1S/C3H8N2/c1-2-5-3-4/h3H,2H2,1H3,(H2,4,5)
FORMULA
C3H8N2

Common name
N'-ethylformamidine
IUPAC name
N'-ethylformamidine
Molecular weight
72.109
clogP
0.003
clogS
-0.267
Frequency
0.0003
HBond Acceptor
1
HBond Donor
2
Total PolarSurface Area
38.38
Number of Rings
0
Rotatable Bond
1
1 ,
1
FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
---|---|---|---|---|---|
2yiv_ligand_2_0.mol2 | 2yiv | 0.666667 | -5.53 | CCN=C | 4 |
1m0q_ligand_1_1.mol2 | 1m0q | 0.666667 | -5.51 | N(=C)CC | 4 |
3ipq_ligand_4_597.mol2 | 3ipq | 0.5 | -5.80 | C/C=[NH]/CC | 5 |
5er1_ligand_2_54.mol2 | 5er1 | 0.5 | -5.71 | C([NH]=C)C(C)C | 6 |
2i4p_ligand_4_590.mol2 | 2i4p | 0.5 | -5.60 | CC/N=C/C | 5 |
4dkt_ligand_1_8.mol2 | 4dkt | 0.5 | -5.48 | C(=N)(C)N | 4 |
102 ,
11