Drug Details

Name:

CHEMBL159695

PubChem ID:

44376100

Pathway:

Show KEGG pathways

InChI:

InChI=1S/C21H26ClN7O5S2/c22-14-3-5-15(6-4-14)36(33,34)29-10-9-28(18(31)13-29)12-17(30)27-16(2-1-7-26-21(23)24)19(32)20-25-8-11-35-20/h3-6,8,11,16H,1-2,7,9-10,12-13H2,(H,27,30)(H4,23,24,26)/t16-/m1/s1

SMILES:

O=C(CN1CCN(CC1=O)S(=O)(=O)c1ccc(cc1)Cl)N[C@@H](C(=O)c1nccs1)CCCN=C(N)N

Properties:

Formula:	C21H26ClN7O5S2	Atoms:	36
Molecular Weight:	556.058	Rotatable Bonds:	12
H-bond Acceptors:	13	H-bond Donors:	3
logP:	2.7988

Targets:

Name	Uniprot ID	Source	References	Interaction
Beta-2-glycoprotein 1	APOH_HUMAN	BindingDB	-	shows
Coagulation factor X	FA10_HUMAN	BindingDB	-	shows
Plasminogen	PLMN_HUMAN	BindingDB	-	shows
Prothrombin	THRB_HUMAN	BindingDB	-	shows
Tissue-type plasminogen activator	TPA_HUMAN	BindingDB	-	shows
Trypsin-1	TRY1_HUMAN	BindingDB	-	shows

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Synonyms:

CHEBI:370534

CHEMBL159695

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