COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK158000
Chemical Name: 2-(5-{4-[(4-chlorophenyl)sulfonyl]piperazin-1-yl}-2-nitrophenyl)-4-methylphthalazin-1(2H)-one
Smiles: Clc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(C)c2c(c1=O)cccc2)[N+](=O)[O-]

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Molecular Weight: 540
Empirical Formula: C25H22ClN5O5S

Physical State: Dry powder
Available Amount: 452 mg

Lipinsky:
logP: 4.033
Rotatable bonds: 0
H-donors: 0
H-acceptors: 5
PSA: 127
Number of rings: 5

     

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