COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK205789
Chemical Name: 2-bromo-N-{4-[4-methyl-5-({2-[(4-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]phenyl}benzamide
Smiles: O=C(Nc1ccc(cc1)[N+](=O)[O-])CSc1nnc(n1C)c1ccc(cc1)NC(=O)c1ccccc1Br

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Molecular Weight: 567.42
Empirical Formula: C24H19BrN6O4S

Physical State: Dry powder
Available Amount: 118 mg

Lipinsky:
logP: 5.632
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 160
Number of rings: 4

     

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