Drug Details

Name:

CHEMBL116245

PubChem ID:

44343993

Pathway:

Show KEGG pathways

InChI:

InChI=1S/C25H33N9O6/c26-24(27)34-12-4-7-18(23(34)38)32-20(35)14-31-21(36)17(8-9-30-22(37)19-13-28-10-11-29-19)33-25(39)40-15-16-5-2-1-3-6-16/h1-3,5-6,10-11,13,17-18,23,38H,4,7-9,12,14-15H2,(H3,26,27)(H,30,37)(H,31,36)(H,32,35)(H,33,39)/t17-,18+,23?/m1/s1

SMILES:

O=C(N[C@@H](C(=O)NCC(=O)N[C@H]1CCCN(C1O)C(=N)N)CCNC(=O)c1nccnc1)OCc1ccccc1

Properties:

Formula:	C25H33N9O6	Atoms:	40
Molecular Weight:	555.586	Rotatable Bonds:	17
H-bond Acceptors:	15	H-bond Donors:	7
logP:	1.1017

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:292384

CHEMBL116245

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