COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK381803
Chemical Name: (2Z,5Z)-2-[(4-acetylphenyl)imino]-3-butyl-5-(5-chloro-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-1,3-thiazolidin-4-one
Smiles: CCCCN1/C(=N/c2ccc(cc2)C(=O)C)/S/C(=c/2\sc3c(n2C)cc(cc3)Cl)/C1=O

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Molecular Weight: 472.03
Empirical Formula: C23H22ClN3O2S2

Physical State: Dry powder
Available Amount: 634 mg

Lipinsky:
logP: 4.432
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 103
Number of rings: 4

     

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