COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK121828
Chemical Name: N-{4-[4-benzyl-5-({1-[(4-methylphenyl)amino]-1-oxobutan-2-yl}sulfanyl)-4H-1,2,4-triazol-3-yl]phenyl}benzamide
Smiles: CCC(C(=O)Nc1ccc(cc1)C)Sc1nnc(n1Cc1ccccc1)c1ccc(cc1)NC(=O)c1ccccc1

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Molecular Weight: 561.71
Empirical Formula: C33H31N5O2S

Physical State: Dry powder
Available Amount: 109 mg

Lipinsky:
logP: 7.82
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 5

     

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