COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK383200
Chemical Name: dimethyl5-{[(2Z,5Z)-3-butyl-5-(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzene-1,3-dicarboxylate
Smiles: CCCCN1/C(=N/c2cc(cc(c2)C(=O)OC)C(=O)OC)/S/C(=c/2\sc3c(n2CC)cccc3)/C1=O

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Molecular Weight: 525.65
Empirical Formula: C26H27N3O5S2

Physical State: Dry powder
Available Amount: 599 mg

Lipinsky:
logP: 4.903
Rotatable bonds: 8
H-donors: 0
H-acceptors: 5
PSA: 139
Number of rings: 4

     

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