Drug Details

Name:

CHEMBL7758

PubChem ID:

44264660

Pathway:

Show KEGG pathways

InChI:

InChI=1S/C29H33N3O4S/c1-30-24-15-11-21(12-16-24)7-6-10-28(29(33)32(2)25-8-4-5-9-25)31-37(34,35)27-18-14-22-19-26(36-3)17-13-23(22)20-27/h11-20,25,28,30-31H,4-5,8-10H2,1-3H3/t28-/m0/s1

SMILES:

CNc1ccc(cc1)C#CC[C@@H](C(=O)N(C1CCCC1)C)NS(=O)(=O)c1ccc2c(c1)ccc(c2)OC

Properties:

Formula:	C29H33N3O4S	Atoms:	37
Molecular Weight:	519.655	Rotatable Bonds:	9
H-bond Acceptors:	7	H-bond Donors:	2
logP:	5.9245

Targets:

Name	Uniprot ID	Source	References	Interaction
Cationic trypsin	TRY1_BOVIN	BindingDB	-	shows
Plasminogen	PLMN_HUMAN	BindingDB	-	shows
Proteinase-activated receptor 1	PAR1_HUMAN	BindingDB	-	shows
Prothrombin	THRB_HUMAN	BindingDB	-	shows
Tissue-type plasminogen activator	TPA_HUMAN	BindingDB	-	shows

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Synonyms:

CHEBI:102286

CHEMBL7758

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