COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK531057
Chemical Name: 8-benzyl-1-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-phenyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Clc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCN(C3)Cc1ccccc1

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Molecular Weight: 598.15
Empirical Formula: C31H24ClN5O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.222
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 124
Number of rings: 7

     

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