COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK724095
Chemical Name: N-(4-bromophenyl)-2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}butanamide
Smiles: CCC(C(=O)Nc1ccc(cc1)Br)Sc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 549.53
Empirical Formula: C28H29BrN4OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 9.834
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 85
Number of rings: 4

     

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