COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK631208
Chemical Name: N-(1,3-benzodioxol-5-ylmethyl)-N~3~-(2-chloro-7H-purin-6-yl)-beta-alaninamide
Smiles: O=C(NCc1ccc2c(c1)OCO2)CCNc1nc(Cl)nc2c1[nH]cn2

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Molecular Weight: 374.79
Empirical Formula: C16H15ClN6O3

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 1.766
Rotatable bonds: 5
H-donors: 3
H-acceptors: 3
PSA: 114
Number of rings: 4

     

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