COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK206058
Chemical Name: 4-(4-chlorophenyl)-2-{5-[(2-hydroxyethyl)sulfanyl]-2-nitrophenyl}phthalazin-1(2H)-one
Smiles: OCCSc1ccc(c(c1)n1nc(c2ccc(cc2)Cl)c2c(c1=O)cccc2)[N+](=O)[O-]

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Molecular Weight: 453.91
Empirical Formula: C22H16ClN3O4S

Physical State: Dry powder
Available Amount: 159 mg

Lipinsky:
logP: 4.245
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 124
Number of rings: 4

     

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