Drug Details

Name:

TAK-442

PubChem ID:

11641515

Pathway:

Show KEGG pathways

InChI:

InChI=1S/C22H26ClN3O5S/c23-17-4-2-16-13-19(5-3-15(16)12-17)32(30,31)14-20(27)21(28)25-10-6-18(7-11-25)26-9-1-8-24-22(26)29/h2-5,12-13,18,20,27H,1,6-11,14H2,(H,24,29)/t20-/m1/s1

SMILES:

Clc1ccc2c(c1)ccc(c2)S(=O)(=O)C[C@H](C(=O)N1CCC(CC1)N1CCCNC1=O)O

Properties:

Formula:	C22H26ClN3O5S	Atoms:	32
Molecular Weight:	479.977	Rotatable Bonds:	6
H-bond Acceptors:	8	H-bond Donors:	2
logP:	3.3195

Targets:

Name	Uniprot ID	Source	References	Interaction
Coagulation factor IX	FA9_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

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Synonyms:

CHEBI:728723

CHEMBL1095032

CID 11641515

CID11641515

TAK-442

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