COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK124384
Chemical Name: 2-bromo-N-[5-({2-[(2-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide
Smiles: O=C(Nc1ccccc1[N+](=O)[O-])CSc1nnc(s1)NC(=O)c1ccccc1Br

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Molecular Weight: 494.35
Empirical Formula: C17H12BrN5O4S2

Physical State: Dry powder
Available Amount: 181 mg

Lipinsky:
logP: 3.848
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 183
Number of rings: 3

     

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