Drug Details

Name:

CHEMBL352119

PubChem ID:

44377303

Pathway:

Show KEGG pathways

InChI:

InChI=1S/C26H41N9O7S.C2HF3O2/c1-42-24(39)18-8-3-2-7-17(18)15-43(40,41)33-20(12-16-6-4-10-34(14-16)25(27)28)22(37)31-13-21(36)32-19-9-5-11-35(23(19)38)26(29)30;3-2(4,5)1(6)7/h2-3,7-8,16,19-20,23,33,38H,4-6,9-15H2,1H3,(H3,27,28)(H3,29,30)(H,31,37)(H,32,36);(H,6,7)/t16?,19-,20+,23?;/m0./s1

SMILES:

OC(=O)C(F)(F)F.COC(=O)c1ccccc1CS(=O)(=O)N[C@@H](C(=O)NCC(=O)N[C@H]1CCCN(C1O)C(=N)N)CC1CCCN(C1)C(=N)N

Properties:

Formula:	C28H42F3N9O9S	Atoms:	50
Molecular Weight:	737.748	Rotatable Bonds:	17
H-bond Acceptors:	18	H-bond Donors:	9
logP:	2.5281

Targets:

Name	Uniprot ID	Source	References	Interaction
Coagulation factor X	FA10_HUMAN	BindingDB	-	shows
Plasminogen	PLMN_HUMAN	BindingDB	-	shows
Prothrombin	THRB_HUMAN	BindingDB	-	shows
Trypsin-1	TRY1_HUMAN	BindingDB	-	shows

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Synonyms:

CHEBI:372996

CHEMBL352119

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