COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK623222
Chemical Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[(2-chloro-7H-purin-6-yl)amino]ethanone
Smiles: O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)CNc1nc(Cl)nc2c1[nH]cn2

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Molecular Weight: 429.87
Empirical Formula: C19H20ClN7O3

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 1.88
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 108
Number of rings: 5

     

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