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SMILES: CC(C)CN(Sc1ccc2OCCOc2c1)[C@H](CO)CCCCNC(=O)[C@@H](Cc1cccc2ccccc12)NC(=O)N1CCOCC1

InChI Key: InChIKey=LRLCMJNSYGOBJY-BHDXBOSCSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 122999   
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
Gag-Pol polyprotein [489-587,G537V,H558K,V571A]


(Human immunodeficiency virus)		BDBM122999
PNG
(US8742158, EX 16)
Show SMILES CC(C)CN(Sc1ccc2OCCOc2c1)[C@H](CO)CCCCNC(=O)[C@@H](Cc1cccc2ccccc12)NC(=O)N1CCOCC1 |r|
Show InChI InChI=1S/C36H48N4O6S/c1-26(2)24-40(47-30-13-14-33-34(23-30)46-21-20-45-33)29(25-41)11-5-6-15-37-35(42)32(38-36(43)39-16-18-44-19-17-39)22-28-10-7-9-27-8-3-4-12-31(27)28/h3-4,7-10,12-14,23,26,29,32,41H,5-6,11,15-22,24-25H2,1-2H3,(H,37,42)(H,38,43)/t29-,32+/m0/s1
PDB
MMDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 2.02n/an/an/an/an/an/a



TaiMed Biologies, Inc.

US Patent


Assay Description
This is a fluorometric assay based on the cleavage by protease of a substrate carrying a donor group (EDANS) and an acceptor group (DABCYL) on each s...

US Patent US8742158 (2014)


BindingDB Entry DOI: 10.7270/Q27H1H7P
More data for this
Ligand-Target Pair