COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK551240
Chemical Name: 1-(4-bromophenyl)-2-{[5-(2-chlorophenyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}ethanone
Smiles: Brc1ccc(cc1)C(=O)CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1Cl

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Molecular Weight: 569.93
Empirical Formula: C25H18BrClN4OS2

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 9.55
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 113
Number of rings: 6

     

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