COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK383052
Chemical Name: (2Z,5Z)-3-cyclohexyl-5-(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)-2-({4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl}imino)-1,3-thiazolidin-4-one
Smiles: OCCN(c1ccc(c(c1)C)/N=C/1\S/C(=c/2\sc3c(n2CC)cccc3)/C(=O)N1C1CCCCC1)CC

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Molecular Weight: 536.76
Empirical Formula: C29H36N4O2S2

Physical State: Dry powder
Available Amount: 437 mg

Lipinsky:
logP: 5.258
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 109
Number of rings: 5

     

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