COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL380827
Chemical Name: 2-{[2-(azepan-1-yl)-2-oxoethyl]sulfanyl}-3-(4-chlorophenyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one
Smiles: Clc1ccc(cc1)n1c(SCC(=O)N2CCCCCC2)nc2c(c1=O)c(C)c(s2)C

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Molecular Weight: 462.04
Empirical Formula: C22H24ClN3O2S2

Physical State: Dry powder
Available Amount: 557 mg

Lipinsky:
logP: 5.671
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 106
Number of rings: 4

     

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