COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK497074
Chemical Name: 7-chloro-2-({[9-(4-methylphenyl)-6-oxo-6,9-dihydro-1H-purin-8-yl]sulfanyl}methyl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: Cc1ccc(cc1)n1c(SCc2cc(=O)n3c(n2)ccc(c3)Cl)nc2c1nc[nH]c2=O

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Molecular Weight: 450.91
Empirical Formula: C21H15ClN6O2S

Physical State: Dry powder
Available Amount: 29 mg

Lipinsky:
logP: 4.095
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 117
Number of rings: 5

     

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