COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK384479
Chemical Name: (2Z,5Z)-3-butyl-2-({4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl}imino)-5-(3-ethyl-5-methoxy-1,3-benzothiazol-2(3H)-ylidene)-1,3-thiazolidin-4-one
Smiles: CCCCN1/C(=N/c2ccc(cc2C)N(CCO)CC)/S/C(=c/2\sc3c(n2CC)cc(cc3)OC)/C1=O

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Molecular Weight: 540.75
Empirical Formula: C28H36N4O3S2

Physical State: Dry powder
Available Amount: 534 mg

Lipinsky:
logP: 4.708
Rotatable bonds: 9
H-donors: 1
H-acceptors: 3
PSA: 119
Number of rings: 4

     

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