COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK453721
Chemical Name: (3,6-dichloro-1-benzothiophen-2-yl){4-[(4-nitrophenyl)carbonyl]piperazin-1-yl}methanone
Smiles: Clc1ccc2c(c1)sc(c2Cl)C(=O)N1CCN(CC1)C(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 464.33
Empirical Formula: C20H15Cl2N3O4S

Physical State: Dry powder
Available Amount: 1408 mg

Lipinsky:
logP: 4.113
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 114
Number of rings: 4

     

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