Drug Details

Name:

2-ketobenzothiazole 69

PubChem ID:

23646613

Pathway:

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InChI:

InChI=1S/C30H37N5O3S/c1-32-23(18-19-8-3-2-4-9-19)30(38)35-17-7-11-24(35)28(37)34-26(20-13-15-21(31)16-14-20)27(36)29-33-22-10-5-6-12-25(22)39-29/h2-6,8-10,12,20-21,23-24,26,32H,7,11,13-18,31H2,1H3,(H,34,37)/t20?,21?,23-,24+,26-/m1/s1

SMILES:

CN[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(=O)c1nc2c(s1)cccc2)C1CCC(CC1)N)Cc1ccccc1

Properties:

Formula:	C30H37N5O3S	Atoms:	39
Molecular Weight:	547.711	Rotatable Bonds:	11
H-bond Acceptors:	9	H-bond Donors:	3
logP:	4.723

Targets:

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

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Synonyms:

()-oxazepam hemisuccinate sodium salt

2-ketobenzothiazole 69

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