BDBM50049913 7-Ethyl-8-isopropyl-7H-pyrrolo[3,2-f]quinazoline-1,3-diamine::CHEMBL170654::TCMDC-137856

SMILES: CCn1c(cc2c1ccc1nc(N)nc(N)c21)C(C)C

InChI Key: InChIKey=NNNLFGJHIHGHAH-UHFFFAOYSA-N

Data: 1 KI

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 = 50049913   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Dihydrofolate Reductase (DHFR) (Candida albicans)	BDBM50049913 (7-Ethyl-8-isopropyl-7H-pyrrolo[3,2-f]quinazoline-1...) Show SMILES CCn1c(cc2c1ccc1nc(N)nc(N)c21)C(C)C Show InChI InChI=1S/C15H19N5/c1-4-20-11-6-5-10-13(14(16)19-15(17)18-10)9(11)7-12(20)8(2)3/h5-8H,4H2,1-3H3,(H4,16,17,18,19)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.330	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wellcome Research Laboratories Curated by ChEMBL					Assay Description Inhibition of Dihydrofolate reductase enzyme from Candida albicans				J Med Chem 39: 892-903 (1996) Article DOI: 10.1021/jm9505122 BindingDB Entry DOI: 10.7270/Q2XD10RC
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