COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK617684
Chemical Name: 3-[(2-chloro-7H-purin-6-yl)sulfanyl]-1-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-one
Smiles: COc1ccccc1N1CCN(CC1)C(=O)CCSc1nc(Cl)nc2c1[nH]cn2

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Molecular Weight: 432.93
Empirical Formula: C19H21ClN6O2S

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 2.576
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 112
Number of rings: 4

     

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