Drug Details

Name:

CHEMBL79304

PubChem ID:

44461750

Pathway:

Show KEGG pathways

InChI:

InChI=1S/C27H32FN5O4S/c1-33(21-5-3-4-6-21)27(34)25(16-19-7-8-20(15-24(19)28)26(29)31-30)32-38(35,36)23-12-10-17-13-22(37-2)11-9-18(17)14-23/h7-15,21,25,32H,3-6,16,30H2,1-2H3,(H2,29,31)/t25-/m0/s1

SMILES:

N/N=C(/c1ccc(c(c1)F)C[C@@H](C(=O)N(C1CCCC1)C)NS(=O)(=O)c1ccc2c(c1)ccc(c2)OC)\N

Properties:

Formula:	C27H32FN5O4S	Atoms:	38
Molecular Weight:	541.638	Rotatable Bonds:	10
H-bond Acceptors:	9	H-bond Donors:	3
logP:	5.7294

Targets:

Name	Uniprot ID	Source	References	Interaction
Cationic trypsin	TRY1_BOVIN	BindingDB	-	shows
Prothrombin	THRB_HUMAN	BindingDB	-	shows

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Synonyms:

CHEBI:232248

CHEMBL79304

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