Drug Details

Name:

CHEMBL163543

PubChem ID:

44377321

Pathway:

Show KEGG pathways

InChI:

InChI=1S/C22H35N9O5.C2HF3O2/c23-20(24)27-10-4-8-15(30-22(35)36-13-14-6-2-1-3-7-14)18(33)28-12-17(32)29-16-9-5-11-31(19(16)34)21(25)26;3-2(4,5)1(6)7/h1-3,6-7,15-16,19,34H,4-5,8-13H2,(H3,25,26)(H,28,33)(H,29,32)(H,30,35)(H4,23,24,27);(H,6,7)/t15-,16+,19?;/m1./s1

SMILES:

OC(=O)C(F)(F)F.O=C(N[C@@H](C(=O)NCC(=O)N[C@H]1CCCN(C1O)C(=N)N)CCCN=C(N)N)OCc1ccccc1

Properties:

Formula:	C24H36F3N9O7	Atoms:	43
Molecular Weight:	619.594	Rotatable Bonds:	17
H-bond Acceptors:	16	H-bond Donors:	9
logP:	2.1882

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:373059

CHEMBL163543

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