COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK085774
Chemical Name: (3-chloro-1-benzothiophen-2-yl)[4-(4-nitrophenyl)piperazin-1-yl]methanone
Smiles: [O-][N+](=O)c1ccc(cc1)N1CCN(CC1)C(=O)c1sc2c(c1Cl)cccc2

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Molecular Weight: 401.87
Empirical Formula: C19H16ClN3O3S

Physical State: Dry powder
Available Amount: 533 mg

Lipinsky:
logP: 5.278
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 97
Number of rings: 4

     

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