General
Preferred name
Thiohexam
Synonyms
N-cyclohexyl-2-benzothiazylsulfenamide ()
N-CYCLOHEXYL-2-BENZOTHIAZOLE SULFENAMIDE ()
N-CYCLOHEXYL-2-BENZOTHIAZOSULFENAMIDE ()
P&D ID
PD013997
CAS
108251-59-8
95-33-0
Tags
available
drug
Drug Status
experimental
approved
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Cell lines
2
Organisms
0
Compound Sets
7
Drug Repurposing Hub
DrugBank
DrugBank Approved Drugs
DrugMatrix
MedChem Express Bioactive Compound Library
NCATS Inxight Approved Drugs
NPC Screening Collection
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
22
Properties
(calculated by RDKit )
Molecular Weight
264.08
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
1
Rotatable Bonds
3
Ring Count
3
Aromatic Ring Count
2
cLogP
4.23
TPSA
24.92
Fraction CSP3
0.46
Chiral centers
0.0
Largest ring
6.0
QED
0.84
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
