COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK675214
Chemical Name: 3-{[(2Z,5Z)-3-benzyl-5-(5-chloro-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]amino}-4-(ethylamino)benzonitrile
Smiles: CCNc1ccc(cc1/N=C/1\S/C(=c/2\sc3c(n2C)cc(cc3)Cl)/C(=O)N1Cc1ccccc1)C#N

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Saltdata: Py(3:2)
Molecular Weight: 532.09
Empirical Formula: C27H22ClN5OS2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.789
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 122
Number of rings: 5

     

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