Responsive image

Common name

N-(3-pyridylmethyl)hydroxylamine

IUPAC name

N-(3-pyridylmethyl)hydroxylamine

SMILES

ONCc1cnccc1

Common name

N-(3-pyridylmethyl)hydroxylamine

IUPAC name

N-(3-pyridylmethyl)hydroxylamine

SMILES

ONCc1cnccc1

INCHI

InChI=1S/C6H8N2O/c9-8-5-6-2-1-3-7-4-6/h1-4,8-9H,5H2

FORMULA

C6H8N2O

Responsive image

Common name

N-(3-pyridylmethyl)hydroxylamine

IUPAC name

N-(3-pyridylmethyl)hydroxylamine





Molecular weight

124.141

clogP

-0.174

clogS

-1.257

Frequency

0.0003





HBond Acceptor

2

HBond Donor

2

Total Polar
Surface Area

33.12

Number of Rings

1

Rotatable Bond

2

Drug ID Common name Structure CAS Compound class Therapeutic area
FDBD01053 Ridogrel Responsive image Platelet Aggregation Inhibitors; Gastrointestinal Agents; Enzyme Inhibitors; Thrombolytic Agents; Used as an adjunctive therapy to induce thrombolysis in patients suffering acute myocardial infarction.
1 , 1
FRAGNAME PDBID SIMILIRITY XSCORE SMILE HAC
3ftw_ligand_2_2.mol2 3ftw 0.804878 -6.51 n1cc(ccc1)C[NH3+] 8
3ftv_ligand_2_2.mol2 3ftv 0.804878 -6.50 n1cc(ccc1)C[NH3+] 8
2r3j_ligand_2_5.mol2 2r3j 0.804878 -6.04 C([NH3+])c1cnccc1 8
4pmt_ligand_2_5.mol2 4pmt 0.804878 -5.98 C(c1cnccc1)[NH3+] 8
2r3n_ligand_2_9.mol2 2r3n 0.804878 -5.94 c1(cnccc1)C[NH3+] 8
2r3o_ligand_2_9.mol2 2r3o 0.804878 -5.92 c1(cnccc1)C[NH3+] 8
3bz3_ligand_2_7.mol2 3bz3 0.804878 -5.89 [NH3+]Cc1cnccc1 8
4gu6_ligand_2_4.mol2 4gu6 0.804878 -5.83 C(c1cccnc1)[NH3+] 8
2r3g_ligand_2_5.mol2 2r3g 0.804878 -5.71 C(c1cccnc1)[NH3+] 8
119 , 12