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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50028136   
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
Dihydrofolate reductase


(Bos taurus (Cattle))		BDBM50028136
PNG
((alpha-n-Bu)2-{4-[(2,4-Diamino-pteridin-6-ylmethyl...)
Show SMILES CCCCOC(=O)C(CCC(O)=O)NC(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1
Show InChI InChI=1S/C24H30N8O5/c1-3-4-11-37-23(36)17(9-10-18(33)34)29-22(35)14-5-7-16(8-6-14)32(2)13-15-12-27-21-19(28-15)20(25)30-24(26)31-21/h5-8,12,17H,3-4,9-11,13H2,1-2H3,(H,29,35)(H,33,34)(H4,25,26,27,30,31)
PDB

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PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 56n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was evaluated in vitro for its ability to inhibit the Dihydrofolate reductase extracted from beef liver.

J Med Chem 27: 605-9 (1984)


BindingDB Entry DOI: 10.7270/Q29G5KSG
More data for this
Ligand-Target Pair