BDBM774 [amino(4-ethylphenyl)methylidene]azanium::benzamidine deriv.::p-ethylbenzamidinium chloride

SMILES: CCc1ccc(cc1)C(N)=[NH2+]

InChI Key: InChIKey=FZMLKENAMKEQOI-UHFFFAOYSA-O

Data: 4 ITC

PDB links: 1 PDB ID contains this monomer as substructures. 1 PDB ID contains inhibitors having a similarity of 90% to this monomer.

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- ITC Data from BindingDB

Found 4 hits for monomerid = 774

Cell (A)	Syringe (B)	Cell Links	Syringe Links	Cell + Syr Links	ΔG° kcal/mole	-TΔS° kcal/mole	ΔH° kcal/mole	log K	pH	Temp °C
Trypsin (Bos taurus (bovine))	BDBM774 ([amino(4-ethylphenyl)methylidene]azanium | benzami...)	DrugBank GoogleScholar KEGG PDB	PC cid PC sid		-6.09	-3.56	-2.53	4.53	8	20
University of Groningen					J Am Chem Soc 125: 10570-9 (2003)
Trypsin (Bos taurus (bovine))	BDBM774 ([amino(4-ethylphenyl)methylidene]azanium | benzami...)	DrugBank GoogleScholar KEGG PDB	PC cid PC sid		-6.07	-2.75	-3.32	4.46	8	25.1
University of Groningen					J Am Chem Soc 125: 10570-9 (2003)
Trypsin (Bos taurus (bovine))	BDBM774 ([amino(4-ethylphenyl)methylidene]azanium | benzami...)	DrugBank GoogleScholar KEGG PDB	PC cid PC sid		-6.09	-1.96	-4.13	4.40	8	30
University of Groningen					J Am Chem Soc 125: 10570-9 (2003)
Trypsin (Bos taurus (bovine))	BDBM774 ([amino(4-ethylphenyl)methylidene]azanium | benzami...)	DrugBank GoogleScholar KEGG PDB	PC cid PC sid		-6.11	-0.763	-5.35	4.32	8	37.1
University of Groningen					J Am Chem Soc 125: 10570-9 (2003)