COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK198661
Chemical Name: 1-benzofuran-2-yl{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}methanone
Smiles: Cc1cc(n(n1)c1cc(ccc1[N+](=O)[O-])N1CCN(CC1)C(=O)c1cc2c(o1)cccc2)C

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Molecular Weight: 445.48
Empirical Formula: C24H23N5O4

Physical State: Dry powder
Available Amount: 209 mg

Lipinsky:
logP: 3.53
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 100
Number of rings: 5

     

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