COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL244382
Chemical Name: N~3~-(2-chloro-7H-purin-6-yl)-N-[5-(2-phenylethyl)-1,3,4-thiadiazol-2-yl]-beta-alaninamide
Smiles: O=C(Nc1nnc(s1)CCc1ccccc1)CCNc1nc(Cl)nc2c1[nH]cn2

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Molecular Weight: 428.9
Empirical Formula: C18H17ClN8OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.146
Rotatable bonds: 5
H-donors: 3
H-acceptors: 1
PSA: 149
Number of rings: 4

     

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