COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK238509
Chemical Name: 4-[3-nitro-4-(piperidin-1-yl)phenyl]-2-[2-oxo-2-(piperidin-1-yl)ethyl]phthalazin-1(2H)-one
Smiles: O=C(N1CCCCC1)Cn1nc(c2ccc(c(c2)[N+](=O)[O-])N2CCCCC2)c2c(c1=O)cccc2

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Molecular Weight: 475.55
Empirical Formula: C26H29N5O4

Physical State: Dry powder
Available Amount: 373 mg

Lipinsky:
logP: 4.573
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 102
Number of rings: 5

     

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