COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK508896
Chemical Name: 4,4'-[(6-chloro-1,3-benzodioxol-5-yl)methanediyl]bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one)
Smiles: Clc1cc2OCOc2cc1C(c1c(C)n(n(c1=O)c1ccccc1)C)c1c(C)n(n(c1=O)c1ccccc1)C

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Molecular Weight: 543.02
Empirical Formula: C30H27ClN4O4

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 3.308
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 65
Number of rings: 6

     

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