Ligand
Ligand Name:   1H-benzimidazol-2-ylmethanethiol
Ligand Type:   non-polymer
Ligand ID:   COVPDB167 PubChem:   95983
Synonym(s):  
  •   4344-85-8
  • 1h-benzimidazole-2-methanethiol
  • (1h-benzo[d]imidazol-2-yl)methanethiol
  • benzimidazol-2-ylmethanethiol
  • 2-benzimidazolemethanethiol
  • bzmt
  • benzimidazol-2-ylmethane-1-thiol
  • (1h-benzoimidazol-2-yl)-methanethiol
  • 2-mercaptomethylbenzimidazol
  • 2-mercaptomethyl benzimidazole
  • schembl131884
  • chembl2358377
  • dtxsid10195855
  • zinc127800
  • nsc46326
  • 1h-benzimidazol-2-ylmethanethiol #
  • bbl012296
  • nsc-46326
  • sbb039214
  • stk737967
  • 1h-1,3-benzodiazol-2-ylmethanethiol
  • 1h-1,3-benzimidazol-2-ylmethanethiol
  • akos000272068
  • 1h-benzimidazol-2-ylmethanethiol x1hcl
  • mcule-9343408707
  • (1h-1,3-benzodiazol-2-yl)methanethiol
  • ncgc00186370-01
  • (1h-benzo[d]imidazol-2-yl)-methanethiol
  • st037294
  • vs-03264
  • db-050652
  • ft-0718038
  • x5686
  • w-6472
  • sr-01000530118
  • j-500178
  • sr-01000530118-1
  • q27453384
  • f0465-0072
  • 2xo
show 39 synonym(s)
DrugBank:   - ChEMBL:   CHEMBL2358377
Canonical SMILES:   c1cccc(c12)nc([nH]2)CS
Standard InChI:   InChI=1S/C8H8N2S/c11-5-8-9-6-3-1-2-4-7(6)10-8/h1-4,11H,5H2,(H,9,10)
Molecular Formula:   C8H8N2S Mol. Weight:   164.04082 logP:   1.9927
HBD:   2 HBA:   2
#Rotatable Bonds:   1 TPSA:   28.68

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
GTPase KRas P01116 (RASK_HUMAN) Homo sapiens (Human) 4PZZ 2XO
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