COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL093817
Chemical Name: 3-(butan-2-yl)-2-({2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-6-methyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Smiles: CCC(n1c(SCC(=O)N2CCN(CC2)c2ccccc2F)nc2c(c1=O)[nH]c(c2)C)C

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Molecular Weight: 457.57
Empirical Formula: C23H28FN5O2S

Physical State: Dry powder
Available Amount: 122 mg

Lipinsky:
logP: 3.123
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 97
Number of rings: 4

     

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