COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK808172
Chemical Name: N-[3-({5-[4-(azepan-1-ylsulfonyl)phenyl]-1,3,4-oxadiazol-2-yl}sulfanyl)propyl]-4-(methylsulfonyl)-2-nitroaniline
Smiles: [O-][N+](=O)c1cc(ccc1NCCCSc1nnc(o1)c1ccc(cc1)S(=O)(=O)N1CCCCCC1)S(=O)(=O)C

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Molecular Weight: 595.72
Empirical Formula: C24H29N5O7S3

Physical State: Dry powder
Available Amount: 97 mg

Lipinsky:
logP: 5.691
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 210
Number of rings: 4

     

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