COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK029024
Chemical Name: (2E)-N-[2-({2-[(2,6-diethylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide
Smiles: CCc1cccc(c1NC(=O)CSc1sc2c(n1)ccc(c2)NC(=O)/C=C/c1ccccc1)CC

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Molecular Weight: 501.67
Empirical Formula: C28H27N3O2S2

Physical State: Dry powder
Available Amount: 361 mg

Lipinsky:
logP: 7.603
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 124
Number of rings: 4

     

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