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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 93213   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)		BDBM93213
PNG
(Benzimidazole Inhibitor, 6)
Show SMILES OC(=O)c1ccc(cc1)-c1ccc2n(CCCNC3CCCCC3)c(nc2c1)-c1c[nH]nc1-c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C32H31Cl2N5O2/c33-26-13-11-23(17-27(26)34)30-25(19-36-38-30)31-37-28-18-22(20-7-9-21(10-8-20)32(40)41)12-14-29(28)39(31)16-4-15-35-24-5-2-1-3-6-24/h7-14,17-19,24,35H,1-6,15-16H2,(H,36,38)(H,40,41)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 350 500n/an/an/an/an/a



Boehringer Ingelheim (Canada) Ltd



Assay Description
In vitro capsid assembly assay (CAA) was used in a HTS to identify potential inhibitors of capsid assembly.

ACS Chem Biol 8: 1074-82 (2013)


Article DOI: 10.1021/cb400075f
BindingDB Entry DOI: 10.7270/Q2W094JX
More data for this
Ligand-Target Pair