COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK147457
Chemical Name: 2-bromo-N-(4-{5-[(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}phenyl)benzamide
Smiles: COc1cc(CCNC(=O)CSc2nnc(n2C)c2ccc(cc2)NC(=O)c2ccccc2Br)ccc1OC

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Molecular Weight: 610.53
Empirical Formula: C28H28BrN5O4S

Physical State: Dry powder
Available Amount: 123 mg

Lipinsky:
logP: 4.832
Rotatable bonds: 9
H-donors: 2
H-acceptors: 4
PSA: 132
Number of rings: 4

     

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