Drug Details

Name:

CHEMBL115707

PubChem ID:

44343972

Pathway:

Show KEGG pathways

InChI:

InChI=1S/C26H35N9O6/c1-16-12-31-20(13-30-16)23(38)29-10-9-18(34-26(40)41-15-17-6-3-2-4-7-17)22(37)32-14-21(36)33-19-8-5-11-35(24(19)39)25(27)28/h2-4,6-7,12-13,18-19,24,39H,5,8-11,14-15H2,1H3,(H3,27,28)(H,29,38)(H,32,37)(H,33,36)(H,34,40)/t18-,19+,24?/m1/s1

SMILES:

O=C(N[C@H]1CCCN(C1O)C(=N)N)CNC(=O)[C@H](NC(=O)OCc1ccccc1)CCNC(=O)c1cnc(cn1)C

Properties:

Formula:	C26H35N9O6	Atoms:	41
Molecular Weight:	569.613	Rotatable Bonds:	17
H-bond Acceptors:	15	H-bond Donors:	7
logP:	1.4101

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:292353

CHEMBL115707

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