COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK628009
Chemical Name: 1-(4-benzylpiperazin-1-yl)-3-[(2-chloro-7H-purin-6-yl)sulfanyl]propan-1-one
Smiles: O=C(N1CCN(CC1)Cc1ccccc1)CCSc1nc(Cl)nc2c1[nH]cn2

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Molecular Weight: 416.93
Empirical Formula: C19H21ClN6OS

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 2.789
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 103
Number of rings: 4

     

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