COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK347530
Chemical Name: 1,3-benzodioxol-5-yl[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]methanone
Smiles: O=C(c1ccc2c(c1)OCO2)N1CCN(CC1)c1c(Cl)cccc1[N+](=O)[O-]

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Molecular Weight: 389.79
Empirical Formula: C18H16ClN3O5

Physical State: Dry powder
Available Amount: 125 mg

Lipinsky:
logP: 3.028
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 87
Number of rings: 4

     

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