COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK110254
Chemical Name: (2E)-3-(4-chlorophenyl)-N-{[2-(4-ethoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}prop-2-enamide
Smiles: CCOc1ccc(cc1)n1nc2c(n1)cc(c(c2)NC(=S)NC(=O)/C=C/c1ccc(cc1)Cl)C

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Molecular Weight: 492
Empirical Formula: C25H22ClN5O2S

Physical State: Dry powder
Available Amount: 333 mg

Lipinsky:
logP: 7.085
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 113
Number of rings: 4

     

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