COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK206424
Chemical Name: (3-chloro-1-benzothiophen-2-yl){4-[4-nitro-3-(piperidin-1-yl)phenyl]piperazin-1-yl}methanone
Smiles: [O-][N+](=O)c1ccc(cc1N1CCCCC1)N1CCN(CC1)C(=O)c1sc2c(c1Cl)cccc2

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Molecular Weight: 485.01
Empirical Formula: C24H25ClN4O3S

Physical State: Dry powder
Available Amount: 180 mg

Lipinsky:
logP: 7.34
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 100
Number of rings: 5

     

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