Drug Details

Name:

CHEMBL469090

PubChem ID:

44569299

Pathway:

Show KEGG pathways

InChI:

InChI=1S/C28H39N7O3S/c29-12-9-19-10-13-35(14-11-19)28(36)25(16-20-3-1-5-22(15-20)27(31)32)34-39(37,38)24-6-2-4-21(17-24)23-7-8-26(30)33-18-23/h1-6,15,17,19,23,25,34H,7-14,16,18,29H2,(H2,30,33)(H3,31,32)/t23?,25-/m0/s1

SMILES:

NCCC1CCN(CC1)C(=O)[C@@H](NS(=O)(=O)c1cccc(c1)C1CCC(=NC1)N)Cc1cccc(c1)C(=N)N

Properties:

Formula:	C28H39N7O3S	Atoms:	39
Molecular Weight:	553.719	Rotatable Bonds:	11
H-bond Acceptors:	10	H-bond Donors:	5
logP:	4.7281

Targets:

Name	Uniprot ID	Source	References	Interaction
Coagulation factor X	FA10_HUMAN	BindingDB	-	shows
Plasminogen	PLMN_HUMAN	BindingDB	-	shows
Prothrombin	THRB_HUMAN	BindingDB	-	shows
Suppressor of tumorigenicity protein 14	ST14_HUMAN	BindingDB	-	shows
Urokinase-type plasminogen activator	UROK_HUMAN	BindingDB	-	shows

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Synonyms:

CHEBI:571260

CHEMBL469090

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