Common name
(NE)-N-(BLAHmethylidene)formamide
IUPAC name
(NE)-N-(BLAHmethylidene)formamide
SMILES
C(=O)/N=C/[NH2+]
Common name
(NE)-N-(BLAHmethylidene)formamide
IUPAC name
(NE)-N-(BLAHmethylidene)formamide
SMILES
C(=O)/N=C/[NH2+]
INCHI
InChI=1S/C2H4N2O/c3-1-4-2-5/h1-2H,(H2,3,4,5)/p+1
FORMULA
C2H4N2O
Common name
(NE)-N-(BLAHmethylidene)formamide
IUPAC name
(NE)-N-(BLAHmethylidene)formamide
Molecular weight
72.066
clogP
-0.276
clogS
0.576
Frequency
0.0003
HBond Acceptor
1
HBond Donor
2
Total PolarSurface Area
55.45
Number of Rings
0
Rotatable Bond
1
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD02336 | fluxametamide |
|
Insecticide | Insecticide |
1 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 1hxw_ligand_frag_9.mol2 | 1hxw | 0.545455 | -5.14 | NC(=O)N=C | 5 |
| 1mjj_ligand_2_12.mol2 | 1mjj | 0.461538 | -5.88 | C(=N\C=O)/C | 5 |
| 1mh5_ligand_2_12.mol2 | 1mh5 | 0.461538 | -5.79 | N(=C\C)/C=O | 5 |
| 1r6g_ligand_2_18.mol2 | 1r6g | 0.461538 | -5.62 | C(=O)/N=C/C | 5 |
| 3n7o_ligand_frag_0.mol2 | 3n7o | 0.461538 | -5.50 | C/C=N/C=O | 5 |
| 2wtj_ligand_2_4.mol2 | 2wtj | 0.461538 | -5.47 | N(=C\C)/C=O | 5 |
| 4imq_ligand_2_58.mol2 | 4imq | 0.461538 | -5.43 | C/C=N/C=O | 5 |
4379 ,
438
