COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK618580
Chemical Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-[(2-chloro-7H-purin-6-yl)sulfanyl]propan-1-one
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)C(Sc1nc(Cl)nc2c1[nH]cn2)C

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Molecular Weight: 437.35
Empirical Formula: C18H18Cl2N6OS

Physical State: Dry powder
Available Amount: 321 mg

Lipinsky:
logP: 3.563
Rotatable bonds: 3
H-donors: 1
H-acceptors: 1
PSA: 103
Number of rings: 4

     

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