COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK453722
Chemical Name: (2-chloro-5-nitrophenyl){4-[(3,6-dichloro-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl}methanone
Smiles: Clc1ccc2c(c1)sc(c2Cl)C(=O)N1CCN(CC1)C(=O)c1cc(ccc1Cl)[N+](=O)[O-]

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Molecular Weight: 498.77
Empirical Formula: C20H14Cl3N3O4S

Physical State: Dry powder
Available Amount: 1365 mg

Lipinsky:
logP: 5.224
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 114
Number of rings: 4

     

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