Drug Details

Name:

CHEMBL297792

PubChem ID:

10718956

Pathway:

Show KEGG pathways

InChI:

InChI=1S/C24H20N2O4S2/c1-16-6-8-17(9-7-16)10-11-19-12-13-23(31-19)32(29,30)26-22(24(27)28)14-18-15-25-21-5-3-2-4-20(18)21/h2-9,12-13,15,22,25-26H,14H2,1H3,(H,27,28)/t22-/m1/s1

SMILES:

OC(=O)[C@H](NS(=O)(=O)c1ccc(s1)C#Cc1ccc(cc1)C)Cc1c[nH]c2c1cccc2

Properties:

Formula:	C24H20N2O4S2	Atoms:	32
Molecular Weight:	464.557	Rotatable Bonds:	6
H-bond Acceptors:	6	H-bond Donors:	3
logP:	5.3835

Targets:

Name	Uniprot ID	Source	References	Interaction
72 kDa type IV collagenase	MMP2_HUMAN	BindingDB	-	shows
Angiotensin-converting enzyme	ACE_HUMAN	BindingDB	-	shows
Interstitial collagenase	MMP1_HUMAN	BindingDB	-	shows
Matrilysin	MMP7_HUMAN	BindingDB	-	shows
Neprilysin	NEP_RAT	BindingDB	-	shows

enlarge table

Synonyms:

(2R)-3-(1H-indol-3-yl)-2-[[5-[2-(4-methylphenyl)ethynyl]thiophen-2-yl]sulf

CHEBI:173325

CHEMBL297792

CID10718956

enlarge table