COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK831102
Chemical Name: 2-[(4-bromobenzyl)sulfanyl]-6,6-dimethyl-3-(2-methylpropyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(Cn1c(SCc2ccc(cc2)Br)nc2c(c1=O)c1CC(C)(C)OCc1s2)C

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Molecular Weight: 493.49
Empirical Formula: C22H25BrN2O2S2

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 6.019
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 95
Number of rings: 4

     

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