COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK030991
Chemical Name: N-[2-({1-[(4-chlorophenyl)amino]-1-oxobutan-2-yl}sulfanyl)-1,3-benzothiazol-6-yl]-4-methylbenzamide
Smiles: CCC(C(=O)Nc1ccc(cc1)Cl)Sc1sc2c(n1)ccc(c2)NC(=O)c1ccc(cc1)C

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Molecular Weight: 496.05
Empirical Formula: C25H22ClN3O2S2

Physical State: Dry powder
Available Amount: 351 mg

Lipinsky:
logP: 6.814
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 124
Number of rings: 4

     

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