COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK384485
Chemical Name: (2Z,5Z)-3-butyl-2-{[4-(diethylamino)-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(CC)CC)/S/C(=c/2\sc3c(n2CC)cc(cc3)OC)/C1=O

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Molecular Weight: 524.75
Empirical Formula: C28H36N4O2S2

Physical State: Dry powder
Available Amount: 628 mg

Lipinsky:
logP: 5.998
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 98
Number of rings: 4

     

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