Ligand
Ligand Name:   naphthalene-1-thiol
Ligand Type:   non-polymer
Ligand ID:   COVPDB166 PubChem:   68259
Synonym(s):  
  •   1-naphthalenethiol
  • 529-36-2
  • 1-thionaphthol
  • 1-mercaptonaphthalene
  • naphthalenethiol
  • unii-9a78cp495h
  • 1-naphthalenethiol, 99%
  • chembl4094874
  • 9a78cp495h
  • mfcd00039599
  • 1-naphthylthiol
  • .alpha.-naphthyl mercaptan
  • naphthalene thiol
  • 1-napthalenethiol
  • naphthalen-1-thiol
  • einecs 208-462-7
  • .alpha.-thionaphthol
  • 1-naphthyl mercaptan
  • acmc-1aycl
  • ai3-14854
  • schembl2647
  • dtxsid6060185
  • zinc1846581
  • bdbm50264546
  • akos009158220
  • mcule-8437414448
  • as-57222
  • o092
  • db-019284
  • ft-0608108
  • st50824786
  • 4-aza-tricyclo[5.2.1.02,6]decane
  • w-105784
  • q27272264
  • 2xh
show 34 synonym(s)
DrugBank:   - ChEMBL:   CHEMBL4094874
Canonical SMILES:   Sc1cccc2ccccc12
Standard InChI:   InChI=1S/C10H8S/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H
Molecular Formula:   C10H8S Mol. Weight:   160.03467 logP:   3.1285
HBD:   1 HBA:   1
#Rotatable Bonds:   0 TPSA:   0.0

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) 4Q01 2XH
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