COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK675792
Chemical Name: 2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-({2-oxo-2-[(2,4,6-trimethylphenyl)amino]ethyl}sulfanyl)-1,3-benzothiazol-6-yl]acetamide
Smiles: O=C(Nc1ccc2c(c1)sc(n2)SCC(=O)Nc1c(C)cc(cc1C)C)CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 706.96
Empirical Formula: C38H38N6O2S3

Physical State: Dry powder
Available Amount: 46 mg

Lipinsky:
logP: 11.016
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 180
Number of rings: 6

     

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