COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382520
Chemical Name: (2Z,5Z)-2-[(3-bromophenyl)imino]-3-butyl-5-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)-1,3-thiazolidin-4-one
Smiles: CCCCN1/C(=N/c2cccc(c2)Br)/S/C(=c/2\sc3c(n2C)cccc3)/C1=O

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Molecular Weight: 474.45
Empirical Formula: C21H20BrN3OS2

Physical State: Dry powder
Available Amount: 736 mg

Lipinsky:
logP: 4.911
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 86
Number of rings: 4

     

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