Drug Details

Name:

CHEMBL285285

PubChem ID:

44285281

Pathway:

Show KEGG pathways

InChI:

InChI=1S/C40H48BN3O6/c1-39(2)30-24-33(39)40(3)34(25-30)49-41(50-40)35(23-28-16-9-5-10-17-28)43-36(45)32-20-13-21-44(32)37(46)31(22-27-14-7-4-8-15-27)42-38(47)48-26-29-18-11-6-12-19-29/h4-12,14-19,30-35H,13,20-26H2,1-3H3,(H,42,47)(H,43,45)/t30?,31-,32-,33?,34?,35?,40-/m0/s1

SMILES:

O=C(N[C@H](C(=O)N1CCC[C@H]1C(=O)NC(B1O[C@H]2[C@](O1)(C)C1CC(C2)C1(C)C)Cc1ccccc1)Cc1ccccc1)OCc1ccccc1

Properties:

Formula:	C40H48BN3O6	Atoms:	50
Molecular Weight:	677.637	Rotatable Bonds:	15
H-bond Acceptors:	9	H-bond Donors:	2
logP:	6.6497

Targets:

Name	Uniprot ID	Source	References	Interaction
Cathepsin G	CATG_HUMAN	BindingDB	-	shows
Cationic trypsin	TRY1_BOVIN	BindingDB	-	shows
Chymotrypsinogen A	CTRA_BOVIN	BindingDB	-	shows
Coagulation factor X	FA10_HUMAN	BindingDB	-	shows
Plasminogen	PLMN_HUMAN	BindingDB	-	shows
Prothrombin	THRB_HUMAN	BindingDB	-	shows
Urokinase-type plasminogen activator	UROK_HUMAN	BindingDB	-	shows

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Synonyms:

CHEBI:155400

CHEMBL285285

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