COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK346358
Chemical Name: 1,3-benzodioxol-5-yl{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Smiles: O=C(c1ccc2c(c1)OCO2)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F

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Molecular Weight: 423.35
Empirical Formula: C19H16F3N3O5

Physical State: Dry powder
Available Amount: 79 mg

Lipinsky:
logP: 3.33
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 87
Number of rings: 4

     

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