COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK271936
Chemical Name: (4-{[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-3-nitrophenyl)(pyridin-2-yl)methanone
Smiles: [O-][N+](=O)c1cc(ccc1Sc1nnc(n1C)c1ccc(cc1)C(C)(C)C)C(=O)c1ccccn1

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Molecular Weight: 473.56
Empirical Formula: C25H23N5O3S

Physical State: Dry powder
Available Amount: 205 mg

Lipinsky:
logP: 6.354
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 131
Number of rings: 4

     

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