COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK808170
Chemical Name: 4-(methylsulfonyl)-2-nitro-N-(3-{[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}propyl)aniline
Smiles: [O-][N+](=O)c1cc(ccc1NCCCSc1nnc(n1c1ccccc1)c1cccs1)S(=O)(=O)C

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Molecular Weight: 515.64
Empirical Formula: C22H21N5O4S3

Physical State: Dry powder
Available Amount: 94 mg

Lipinsky:
logP: 6.205
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 184
Number of rings: 4

     

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