COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK154744
Chemical Name: 4-(4-chlorophenyl)-2-{5-[4-(ethylsulfonyl)piperazin-1-yl]-2-nitrophenyl}phthalazin-1(2H)-one
Smiles: CCS(=O)(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(c2ccc(cc2)Cl)c2c(c1=O)cccc2)[N+](=O)[O-]

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Molecular Weight: 554.03
Empirical Formula: C26H24ClN5O5S

Physical State: Dry powder
Available Amount: 389 mg

Lipinsky:
logP: 4.367
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 127
Number of rings: 5

     

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