Common name
2-hydroxy-N-phenylacetamide
IUPAC name
2-hydroxy-N-phenylacetamide
SMILES
c1(ccccc1)NC(=O)CO
Common name
2-hydroxy-N-phenylacetamide
IUPAC name
2-hydroxy-N-phenylacetamide
SMILES
c1(ccccc1)NC(=O)CO
INCHI
InChI=1S/C8H9NO2/c10-6-8(11)9-7-4-2-1-3-5-7/h1-5,10H,6H2,(H,9,11)
FORMULA
C8H9NO2
Common name
2-hydroxy-N-phenylacetamide
IUPAC name
2-hydroxy-N-phenylacetamide
Molecular weight
151.163
clogP
0.755
clogS
-1.453
Frequency
0.0003
HBond Acceptor
2
HBond Donor
2
Total PolarSurface Area
49.33
Number of Rings
1
Rotatable Bond
2
1 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 4dho_ligand_3_16.mol2 | 4dho | 1 | -5.49 | C(O)C(=O)Nc1ccccc1 | 11 |
| 4dhm_ligand_3_16.mol2 | 4dhm | 1 | -5.42 | c1(ccccc1)NC(=O)CO | 11 |
| 3b68_ligand_1_0.mol2 | 3b68 | 0.805556 | -7.48 | c1(ccccc1)NC(=O)C | 10 |
| 3chs_ligand_2_2.mol2 | 3chs | 0.805556 | -7.46 | CC(=O)Nc1ccccc1 | 10 |
| 3chr_ligand_2_11.mol2 | 3chr | 0.805556 | -7.40 | CC(=O)Nc1ccccc1 | 10 |
| 3chq_ligand_2_15.mol2 | 3chq | 0.805556 | -7.36 | CC(=O)Nc1ccccc1 | 10 |
| 3n86_ligand_2_4.mol2 | 3n86 | 0.805556 | -7.31 | CC(=O)Nc1ccccc1 | 10 |
| 4msk_ligand_2_9.mol2 | 4msk | 0.805556 | -7.22 | c1(ccccc1)NC(=O)C | 10 |
100 ,
11
