COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK864204
Chemical Name: 2-{[2-(1,3-benzothiazol-2-ylsulfonyl)ethyl]sulfanyl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: N#Cc1cc2CCCCc2nc1SCCS(=O)(=O)c1nc2c(s1)cccc2

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Molecular Weight: 415.56
Empirical Formula: C19H17N3O2S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.958
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 145
Number of rings: 4

     

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