COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL357646
Chemical Name: 4-tert-butyl-N-{4-[4-methyl-5-({2-[(4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]phenyl}benzamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc(n1C)c1ccc(cc1)NC(=O)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 513.66
Empirical Formula: C29H31N5O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.853
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 4

     

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