COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047551
Chemical Name: 6-hydroxy-3-methyl-8-(4-phenylpiperazin-1-yl)-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3,7-dihydro-2H-purin-2-one
Smiles: O=c1nc(O)c2c(n1C)nc(n2CCSc1nnnn1c1ccccc1)N1CCN(CC1)c1ccccc1

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Molecular Weight: 530.61
Empirical Formula: C25H26N10O2S

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 2.523
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 146
Number of rings: 6

     

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