COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL287929
Chemical Name: N~3~-(2-chloro-9H-purin-6-yl)-N-{[4-(4-methoxyphenyl)tetrahydro-2H-pyran-4-yl]methyl}-beta-alaninamide
Smiles: COc1ccc(cc1)C1(CCOCC1)CNC(=O)CCNc1nc(Cl)nc2c1nc[nH]2

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Molecular Weight: 444.92
Empirical Formula: C21H25ClN6O3

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 2.205
Rotatable bonds: 5
H-donors: 3
H-acceptors: 3
PSA: 114
Number of rings: 4

     

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