COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK198778
Chemical Name: 1-[(4-chlorophenyl)sulfonyl]-4-{3-[(furan-2-ylmethyl)sulfanyl]-4-nitrophenyl}piperazine
Smiles: Clc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)SCc1ccco1)[N+](=O)[O-]

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Molecular Weight: 493.99
Empirical Formula: C21H20ClN3O5S2

Physical State: Dry powder
Available Amount: 174 mg

Lipinsky:
logP: 5.031
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 133
Number of rings: 4

     

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