COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK381825
Chemical Name: (2Z,5Z)-3-butyl-5-(5-chloro-3-ethyl-1,3-benzothiazol-2(3H)-ylidene)-2-({4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl}imino)-1,3-thiazolidin-4-one
Smiles: CCCCN1/C(=N/c2ccc(cc2C)N(CCO)CC)/S/C(=c/2\sc3c(n2CC)cc(cc3)Cl)/C1=O

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Molecular Weight: 545.17
Empirical Formula: C27H33ClN4O2S2

Physical State: Dry powder
Available Amount: 351 mg

Lipinsky:
logP: 5.388
Rotatable bonds: 8
H-donors: 1
H-acceptors: 2
PSA: 109
Number of rings: 4

     

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