Responsive image

Common name

N-[2-(1H-imidazol-5-yl)ethyl]formamide

IUPAC name

N-[2-(1H-imidazol-5-yl)ethyl]formamide

SMILES

C(CNC=O)c1[nH]cnc1

Common name

N-[2-(1H-imidazol-5-yl)ethyl]formamide

IUPAC name

N-[2-(1H-imidazol-5-yl)ethyl]formamide

SMILES

C(CNC=O)c1[nH]cnc1

INCHI

InChI=1S/C6H9N3O/c10-5-7-2-1-6-3-8-4-9-6/h3-5H,1-2H2,(H,7,10)(H,8,9)

FORMULA

C6H9N3O

Responsive image

Common name

N-[2-(1H-imidazol-5-yl)ethyl]formamide

IUPAC name

N-[2-(1H-imidazol-5-yl)ethyl]formamide





Molecular weight

139.155

clogP

0.910

clogS

-1.714

Frequency

0.0003





HBond Acceptor

2

HBond Donor

2

Total Polar
Surface Area

57.78

Number of Rings

1

Rotatable Bond

3

Drug ID Common name Structure CAS Compound class Therapeutic area
FDBD00100 Remikiren Responsive image Cardiovascular System; Agents Acting on the Renin-Angiotensin System; Renin-Inhibitors; For the treatment of hypertension and heart failure.
1 , 1
FRAGNAME PDBID SIMILIRITY XSCORE SMILE HAC
1b3f_ligand_3_308.mol2 1b3f 1 -6.22 C(=O)NCCc1c[nH+]c[nH]1 10
3d91_ligand_3_441.mol2 3d91 1 -5.87 C(NC=O)Cc1c[nH+]c[nH]1 10
3eys_ligand_3_664.mol2 3eys 1 -5.69 C(c1[nH+]c[nH]c1)CNC=O 10
3gjq_ligand_3_425.mol2 3gjq 1 -5.55 C(NC=O)Cc1[nH+]c[nH]c1 10
2qlj_ligand_3_270.mol2 2qlj 1 -5.47 C(=O)NCCc1[nH+]c[nH]c1 10
1ent_ligand_3_596.mol2 1ent 1 -5.39 C(c1c[nH+]c[nH]1)CNC=O 10
1fq7_ligand_3_541.mol2 1fq7 1 -5.33 C(Cc1[nH+]c[nH]c1)NC=O 10
3hik_ligand_3_404.mol2 3hik 1 -5.33 C(Cc1[nH+]c[nH]c1)NC=O 10
100 , 11