COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK383479
Chemical Name: dimethyl5-{[(2Z,5Z)-3-cyclohexyl-5-(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzene-1,3-dicarboxylate
Smiles: COC(=O)c1cc(cc(c1)C(=O)OC)/N=C/1\S/C(=c/2\sc3c(n2CC)cccc3)/C(=O)N1C1CCCCC1

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Molecular Weight: 551.69
Empirical Formula: C28H29N3O5S2

Physical State: Dry powder
Available Amount: 485 mg

Lipinsky:
logP: 5.369
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 139
Number of rings: 5

     

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