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BDBM95399 1'H-spiro[cyclopentane-1,2'-quinazoline]-4'(3'H)-thione::4-spiro[1,3-dihydroquinazoline-2,1'-cyclopentane]thione::MLS000730176::SMR000308452::cid_686361::spiro[1,3-dihydroquinazoline-2,1'-cyclopentane]-4-thione

SMILES: S=C1NC2(CCCC2)Nc2ccccc12

InChI Key: InChIKey=CVKBGNGVPMPNQU-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 95399   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
MSRA protein


(Bos taurus)
BDBM95399
PNG
(1'H-spiro[cyclopentane-1,2'-quinazoline]-4...)
Show SMILES S=C1NC2(CCCC2)Nc2ccccc12
Show InChI InChI=1S/C12H14N2S/c15-11-9-5-1-2-6-10(9)13-12(14-11)7-3-4-8-12/h1-2,5-6,13H,3-4,7-8H2,(H,14,15)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 5.36E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




Citation and Details
More data for this
Ligand-Target Pair