COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK464077
Chemical Name: N-[4-(morpholin-4-ylsulfonyl)phenyl]-4-[(4-nitrophenyl)sulfonyl]piperazine-1-carbothioamide
Smiles: S=C(N1CCN(CC1)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-])Nc1ccc(cc1)S(=O)(=O)N1CCOCC1

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Molecular Weight: 555.66
Empirical Formula: C21H25N5O7S3

Physical State: Dry powder
Available Amount: 408 mg

Lipinsky:
logP: 1.968
Rotatable bonds: 0
H-donors: 1
H-acceptors: 7
PSA: 193
Number of rings: 4

     

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