COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK664718
Chemical Name: [4-({5-[(benzylsulfanyl)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-3-nitrophenyl](pyridin-2-yl)methanone
Smiles: [O-][N+](=O)c1cc(ccc1Sc1nnc(n1c1ccccc1)CSCc1ccccc1)C(=O)c1ccccn1

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Molecular Weight: 539.64
Empirical Formula: C28H21N5O3S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 7.154
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 157
Number of rings: 5

     

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